ethyl 4-methyl-2-(3-nitrophenyl)-2,5-dihydro-1H-1,5-benzodiazepine-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-(3-nitrophenyl)-2,5-dihydro-1H-1,5-benzodiazepine-3-carboxylate Openeye Name: ethyl 4-methyl-2-(3-nitrophenyl)-2,5-dihydro-1H-1,5-benzodiazepine-3-carboxylate CAS Name: 4-methyl-2-(3-nitrophenyl)-2,5-dihydro-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-(3-nitrophenyl)-2,5-dihydro-1H-1,5-benzodiazepine-3-carboxylate Traditional Name: 4-methyl-2-(3-nitrophenyl)-2,5-dihydro-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=CC=CC=C2NC1C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(NC2=CC=CC=C2NC1C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C19H19N3O4/c1-3-26-19(23)17-12(2)20-15-9-4-5-10-16(15)21-18(17)13-7-6-8-14(11-13)22(24)25/h4-11,18,20-21H,3H2,1-2H3