3-(8-chloro-6-methylbenzo[b][1,5]benzoxathiepin-6-yl)propyl-dimethylazanium;2-hydroxy-2-oxoacetate
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![3-(8-chloro-6-methylbenzo[b][1,5]benzoxathiepin-6-yl)propyl-dimethylazanium;2-hydroxy-2-oxoacetate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/1b8b2d219242407aad7381ea3da42e02.png "3-(8-chloro-6-methylbenzo[b][1,5]benzoxathiepin-6-yl)propyl-dimethylazanium;2-hydroxy-2-oxoacetate")
3-(8-chloro-6-methylbenzo[b][1,5]benzoxathiepin-6-yl)propyl-dimethylazanium;2-hydroxy-2-oxoacetate
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CAS No:
83986-10-1
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Formula:
C21H24ClNO5S
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Chemical Name:
3-(8-chloro-6-methylbenzo[b][1,5]benzoxathiepin-6-yl)propyl-dimethylazanium;2-hydroxy-2-oxoacetate
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Synonyms:
83986-10-1;2-Chloro-N,N,11-trimethyl-11H-dibenz(b,e)(1,4)oxathiepin-11-propanamine oxalate;8-Chloro-6-methyl-6-(3-dimethylaminopropyl)-6H-dibenz(b,e)-1,4-oxathiepin hydrogen oxalate;11H-Dibenz(b,e)(1,4)oxathiepin-11-propanamine, 2-chloro-N,N,11-trimethyl-, ethanedioate (1:1)
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CAS No:
3-(8-chloro-6-methylbenzo[b][1,5]benzoxathiepin-6-yl)propyl-dimethylazanium;2-hydroxy-2-oxoacetate Basic Attributes
437.9 g/mol
437.1063717 g/mol
Computed Properties
Molecular Weight:437.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:437.1063717
Monoisotopic Mass:437.1063717
Topological Polar Surface Area:116
Heavy Atom Count:29
Complexity:472
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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