disodium 4-[4-[[3-[benzyl[3-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]azo]benzoyl]amino]-p-tolyl]azo]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulphonate
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![disodium 4-[4-[[3-[benzyl[3-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]azo]benzoyl]amino]-p-tolyl]azo]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulphonate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a4c4ffd7213544c2bafdd09bb0a3e796.png "disodium 4-[4-[[3-[benzyl[3-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]azo]benzoyl]amino]-p-tolyl]azo]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulphonate")
disodium 4-[4-[[3-[benzyl[3-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]azo]benzoyl]amino]-p-tolyl]azo]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulphonate
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CAS No:
93783-19-8
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Formula:
C41H35N9O9S2.2Na
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Chemical Name:
disodium 4-[4-[[3-[benzyl[3-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]azo]benzoyl]amino]-p-tolyl]azo]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulphonate
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Synonyms:
Benzenesulfonic acid,4-[4-[[3-[[3-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]azo]benzoyl](phenylmethyl)amino]-4-methylphenyl]azo]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]-,disodium salt
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CAS No:
disodium 4-[4-[[3-[benzyl[3-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]azo]benzoyl]amino]-p-tolyl]azo]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulphonate Basic Attributes
905.86516
905.164
298-225-4
Computed Properties
Molecular Weight:905.9
Hydrogen Bond Acceptor Count:15
Rotatable Bond Count:10
Exact Mass:905.16380458
Monoisotopic Mass:905.16380458
Topological Polar Surface Area:266
Heavy Atom Count:63
Complexity:1940
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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disodium 4-[4-[[3-[benzyl[3-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]azo]benzoyl]amino]-p-tolyl]azo]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulphonate
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