[(2R)-3-[(1-ethylpyridin-1-ium-2-yl)methyl-(2-methoxybenzoyl)carbamoyl]oxy-2-methoxypropyl] 4-(octadecylcarbamoyloxy)piperidine-1-carboxylate;chloride
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![[(2R)-3-[(1-ethylpyridin-1-ium-2-yl)methyl-(2-methoxybenzoyl)carbamoyl]oxy-2-methoxypropyl] 4-(octadecylcarbamoyloxy)piperidine-1-carboxylate;chloride structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/0b949db4b7bb4aaaad0002dbe8f13d3f.png "[(2R)-3-[(1-ethylpyridin-1-ium-2-yl)methyl-(2-methoxybenzoyl)carbamoyl]oxy-2-methoxypropyl] 4-(octadecylcarbamoyloxy)piperidine-1-carboxylate;chloride")
[(2R)-3-[(1-ethylpyridin-1-ium-2-yl)methyl-(2-methoxybenzoyl)carbamoyl]oxy-2-methoxypropyl] 4-(octadecylcarbamoyloxy)piperidine-1-carboxylate;chloride
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CAS No:
128420-61-1
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Formula:
C46H73ClN4O9
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Chemical Name:
[(2R)-3-[(1-ethylpyridin-1-ium-2-yl)methyl-(2-methoxybenzoyl)carbamoyl]oxy-2-methoxypropyl] 4-(octadecylcarbamoyloxy)piperidine-1-carboxylate;chloride
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Synonyms:
1-ethyl-2-(N-(2-methoxy)benzoyl-N-(2-methoxy-3-(4-octadecylcarbamoyloxy)piperidinocarbonyloxypropyloxy)carbonyl)aminomethylpyridinium chloride;E 5880;E-5880;Minopafant;UNII-I7J5MAD9ZU;Minopafant [INN];E-5880;I7J5MAD9ZU;128420-61-1;E 5880;Minopafant (INN);NCGC00183020-01;Menopafant (JAN);DSSTox_CID_28724;DSSTox_RID_82993;DSSTox_GSID_48798;CHEMBL2104419;DTXSID7048798;Tox21_113275;1-Ethyl-2-(N-(2-methoxy)benzoyl-N-(2-methoxy-3-(4-octadecylcarbamoyloxy)piperidinocarbonyloxypropyloxy)carbonyl)aminomethylpyridinium chloride;CAS-128420-61-1;D02158;Q27280548;(+)-1-Ethyl-2-((N-(((2R)-2-methoxy-3-(((4-((octadecylcarbamoyl)oxy)piperidino)carbonyl)oxy)propoxy)carbonyl)-o-anisamido)methyl)pyridinium chloride;Pyridinium, 1-ethyl-2-(((2-methoxybenzoyl)((2-methoxy-3-(((4-(((octadecylamino)carbonyl)oxy)-1-piperidinyl)carbonyl)oxy)propoxy)carbonyl)amino)methyl)-, chloride, (R)-
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CAS No:
[(2R)-3-[(1-ethylpyridin-1-ium-2-yl)methyl-(2-methoxybenzoyl)carbamoyl]oxy-2-methoxypropyl] 4-(octadecylcarbamoyloxy)piperidine-1-carboxylate;chloride Basic Attributes
861.5 g/mol
860.5066076 g/mol
I7J5MAD9ZU
DTXSID7048798
Drug Information
1-ethyl-2-(N-(2-methoxy)benzoyl-N-(2-methoxy-3-(4-octadecylcarbamoyloxy)piperidinocarbonyloxypropyloxy)carbonyl)aminomethylpyridinium chloride
Computed Properties
Molecular Weight:861.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:31
Exact Mass:860.5066076
Monoisotopic Mass:860.5066076
Topological Polar Surface Area:137
Heavy Atom Count:60
Complexity:1150
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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