methyl 6-acetamido-7-chloranyl-3,4-dihydro-2H-1,5-benzodiazepine-9-carboxylate

Systemtic Name: methyl 6-acetamido-7-chloranyl-3,4-dihydro-2H-1,5-benzodiazepine-9-carboxylate Openeye Name: methyl 6-acetamido-7-chloro-3,4-dihydro-2H-1,5-benzodiazepine-9-carboxylate CAS Name: 6-acetamido-7-chloro-3,4-dihydro-2H-1,5-benzodiazepine-9-carboxylic acid methyl ester IUPAC Name: methyl 6-acetamido-7-chloro-3,4-dihydro-2H-1,5-benzodiazepine-9-carboxylate Traditional Name: 6-acetamido-7-chloro-3,4-dihydro-2H-1,5-benzodiazepine-9-carboxylic acid methyl ester Formula: C13H14ClN3O3 MolecularWeight: 295.72156

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C2=NCCCN=C12)C(=O)OC)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C2=NCCCN=C12)C(=O)OC)Cl

InChI

InChI=1S/C13H14ClN3O3/c1-7(18)17-11-9(14)6-8(13(19)20-2)10-12(11)16-5-3-4-15-10/h6H,3-5H2,1-2H3,(H,17,18)