CAS
87996-57-4 Purity
96%
87996-57-4 Purity
96%
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2-(11-Cyano-6H-benzo[c][1]benzothiepin-11-yl)ethyl-dimethylazanium;2-hydroxy-2-oxoacetate
CAS
87997-49-7
Catalog Number
ACM87997497
Category
Other Products
Molecular Weight
398.475 g/mol
Molecular Formula
C21H22N2O4S
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Specification
IUPAC Name
2-(11-cyano-6H-benzo[c][1]benzothiepin-11-yl)ethyl-dimethylazanium;2-hydroxy-2-oxoacetate
Canonical SMILES
C[NH+](C)CCC1(C2=CC=CC=C2CSC3=CC=CC=C31)C#N.C(=O)(C(=O)[O-])O
InChI Key
JBJGHWZXZBQYOA-UHFFFAOYSA-N
Exact Mass
398.13000
H-Bond Acceptor
6
H-Bond Donor
2
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