1-methyl-5-[(E)-2-(5-nitro-2-phenoxy-phenyl)ethenyl]-2,3-dihydro-1,4-benzodiazepine

Systemtic Name: 1-methyl-5-[(E)-2-(5-nitro-2-phenoxy-phenyl)ethenyl]-2,3-dihydro-1,4-benzodiazepine Openeye Name: 1-methyl-5-[(E)-2-(5-nitro-2-phenoxy-phenyl)vinyl]-2,3-dihydro-1,4-benzodiazepine CAS Name: 1-methyl-5-[(E)-2-(5-nitro-2-phenoxyphenyl)ethenyl]-2,3-dihydro-1,4-benzodiazepine IUPAC Name: 1-methyl-5-[(E)-2-(5-nitro-2-phenoxyphenyl)ethenyl]-2,3-dihydro-1,4-benzodiazepine Traditional Name: 1-methyl-5-[(E)-2-(5-nitro-2-phenoxy-phenyl)vinyl]-2,3-dihydro-1,4-benzodiazepine Formula: C24H21N3O3 MolecularWeight: 399.44184

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN=C(C2=CC=CC=C21)C=CC3=C(C=CC(=C3)[N+](=O)[O-])OC4=CC=CC=C4

Isomeric SMILES

CN1CCN=C(C2=CC=CC=C21)/C=C/C3=C(C=CC(=C3)[N+](=O)[O-])OC4=CC=CC=C4

InChI

InChI=1S/C24H21N3O3/c1-26-16-15-25-22(21-9-5-6-10-23(21)26)13-11-18-17-19(27(28)29)12-14-24(18)30-20-7-3-2-4-8-20/h2-14,17H,15-16H2,1H3/b13-11+