2-(3,4-dimethoxyphenyl)-4-(3-nitrophenyl)-2,3-dihydro-1H-1,5-benzodiazepine

Systemtic Name: 2-(3,4-dimethoxyphenyl)-4-(3-nitrophenyl)-2,3-dihydro-1H-1,5-benzodiazepine Openeye Name: 2-(3,4-dimethoxyphenyl)-4-(3-nitrophenyl)-2,3-dihydro-1H-1,5-benzodiazepine CAS Name: 2-(3,4-dimethoxyphenyl)-4-(3-nitrophenyl)-2,3-dihydro-1H-1,5-benzodiazepine IUPAC Name: 2-(3,4-dimethoxyphenyl)-4-(3-nitrophenyl)-2,3-dihydro-1H-1,5-benzodiazepine Traditional Name: 2-(3,4-dimethoxyphenyl)-4-(3-nitrophenyl)-2,3-dihydro-1H-1,5-benzodiazepine Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=NC3=CC=CC=C3N2)C4=CC(=CC=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(=NC3=CC=CC=C3N2)C4=CC(=CC=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C23H21N3O4/c1-29-22-11-10-16(13-23(22)30-2)21-14-20(15-6-5-7-17(12-15)26(27)28)24-18-8-3-4-9-19(18)25-21/h3-13,21,25H,14H2,1-2H3