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Details

Stereochemistry ACHIRAL
Molecular Formula C18H15ClN2O4
Molecular Weight 358.776
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-Chloro-1,2,3,4-tetrahydro-1-(2-methyl-4-nitrobenzoyl)-5H-1-benzazepin-5-one

SMILES

CC1=C(C=CC(=C1)[N+]([O-])=O)C(=O)N2CCCC(=O)C3=CC(Cl)=CC=C23

InChI

InChIKey=NNCRQBJNAGEBDM-UHFFFAOYSA-N
InChI=1S/C18H15ClN2O4/c1-11-9-13(21(24)25)5-6-14(11)18(23)20-8-2-3-17(22)15-10-12(19)4-7-16(15)20/h4-7,9-10H,2-3,8H2,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
7-Chloro-1,2,3,4-tetrahydro-1-(2-methyl-4-nitrobenzoyl)-5H-1-benzazepin-5-one
Systematic Name English
7-Chloro-1-(2-methyl-4-nitrobenzoyl)-3,4-dihydro-1H-benzo[b]azepin-5(2H)-one
Systematic Name English
7-Chloro-1-(2-methyl-4-nitrobenzoyl)-5-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine
Systematic Name English
5H-1-Benzazepin-5-one, 7-chloro-1,2,3,4-tetrahydro-1-(2-methyl-4-nitrobenzoyl)-
Systematic Name English
7-Chloro-1-(2-methyl-4-nitrobenzoyl)-5-oxo-2,3,4,5+tetrahydro-1H-1-benzazepine
Systematic Name English
1-(2-Methyl-4-nitrobenzoyl)-7-chloro-1,2,3,4-tetrahydrobenzo[b]azepin-5-one
Systematic Name English
Code System Code Type Description
CAS
137982-91-3
Created by admin on Sat Dec 16 19:29:15 GMT 2023 , Edited by admin on Sat Dec 16 19:29:15 GMT 2023
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PUBCHEM
19608065
Created by admin on Sat Dec 16 19:29:15 GMT 2023 , Edited by admin on Sat Dec 16 19:29:15 GMT 2023
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FDA UNII
EWB5QJ6P82
Created by admin on Sat Dec 16 19:29:15 GMT 2023 , Edited by admin on Sat Dec 16 19:29:15 GMT 2023
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EPA CompTox
DTXSID50599035
Created by admin on Sat Dec 16 19:29:15 GMT 2023 , Edited by admin on Sat Dec 16 19:29:15 GMT 2023
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