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Details

Stereochemistry RACEMIC
Molecular Formula C19H18ClNO5S
Molecular Weight 407.868
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 7-chloro-2,3,4,5-tetrahydro-1-[(4-methylphenyl)sulfonyl]-5-oxo-1H-1-benzazepine-4-carboxylate

SMILES

COC(=O)C1CCN(C2=CC=C(Cl)C=C2C1=O)S(=O)(=O)C3=CC=C(C)C=C3

InChI

InChIKey=AZFGERHWILZJHY-UHFFFAOYSA-N
InChI=1S/C19H18ClNO5S/c1-12-3-6-14(7-4-12)27(24,25)21-10-9-15(19(23)26-2)18(22)16-11-13(20)5-8-17(16)21/h3-8,11,15H,9-10H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
Methyl 7-chloro-2,3,4,5-tetrahydro-1-[(4-methylphenyl)sulfonyl]-5-oxo-1H-1-benzazepine-4-carboxylate
Systematic Name English
1H-1-Benzazepine-4-carboxylic acid, 7-chloro-2,3,4,5-tetrahydro-1-[(4-methylphenyl)sulfonyl]-5-oxo-, methyl ester
Systematic Name English
Code System Code Type Description
FDA UNII
JBB9E969FV
Created by admin on Sat Dec 16 19:30:50 GMT 2023 , Edited by admin on Sat Dec 16 19:30:50 GMT 2023
PRIMARY
PUBCHEM
101380716
Created by admin on Sat Dec 16 19:30:50 GMT 2023 , Edited by admin on Sat Dec 16 19:30:50 GMT 2023
PRIMARY
CAS
1448365-49-8
Created by admin on Sat Dec 16 19:30:50 GMT 2023 , Edited by admin on Sat Dec 16 19:30:50 GMT 2023
PRIMARY