ethyl 7-chloranyl-2-(methylamino)-5-phenyl-3,4-dihydro-1,4-benzodiazepine-5-carboxylate

Systemtic Name: ethyl 7-chloranyl-2-(methylamino)-5-phenyl-3,4-dihydro-1,4-benzodiazepine-5-carboxylate Openeye Name: ethyl 7-chloro-2-(methylamino)-5-phenyl-3,4-dihydro-1,4-benzodiazepine-5-carboxylate CAS Name: 7-chloro-2-(methylamino)-5-phenyl-3,4-dihydro-1,4-benzodiazepine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 7-chloro-2-(methylamino)-5-phenyl-3,4-dihydro-1,4-benzodiazepine-5-carboxylate Traditional Name: 7-chloro-2-(methylamino)-5-phenyl-3,4-dihydro-1,4-benzodiazepine-5-carboxylic acid ethyl ester Formula: C19H20ClN3O2 MolecularWeight: 357.834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C2=C(C=CC(=C2)Cl)N=C(CN1)NC)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(C2=C(C=CC(=C2)Cl)N=C(CN1)NC)C3=CC=CC=C3

InChI

InChI=1S/C19H20ClN3O2/c1-3-25-18(24)19(13-7-5-4-6-8-13)15-11-14(20)9-10-16(15)23-17(21-2)12-22-19/h4-11,22H,3,12H2,1-2H3,(H,21,23)