ethyl 1-(4-aminophenyl)-8-chloranyl-4-methyl-4,5-dihydro-2,3-benzodiazepine-3-carboxylate

Systemtic Name: ethyl 1-(4-aminophenyl)-8-chloranyl-4-methyl-4,5-dihydro-2,3-benzodiazepine-3-carboxylate Openeye Name: ethyl 1-(4-aminophenyl)-8-chloro-4-methyl-4,5-dihydro-2,3-benzodiazepine-3-carboxylate CAS Name: 1-(4-aminophenyl)-8-chloro-4-methyl-4,5-dihydro-2,3-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-aminophenyl)-8-chloro-4-methyl-4,5-dihydro-2,3-benzodiazepine-3-carboxylate Traditional Name: 1-(4-aminophenyl)-8-chloro-4-methyl-4,5-dihydro-2,3-benzodiazepine-3-carboxylic acid ethyl ester Formula: C19H20ClN3O2 MolecularWeight: 357.834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(CC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=C(C=C3)N)C

Isomeric SMILES

CCOC(=O)N1C(CC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=C(C=C3)N)C

InChI

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