7-nitro-2-oxidanylidene-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carbaldehyde

Systemtic Name: 7-nitro-2-oxidanylidene-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carbaldehyde Openeye Name: 7-nitro-2-oxo-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carbaldehyde CAS Name: 7-nitro-2-oxo-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carboxaldehyde IUPAC Name: 7-nitro-2-oxo-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carbaldehyde Traditional Name: 2-keto-7-nitro-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carbaldehyde Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(N1C=O)C3=CC=CC=C3

Isomeric SMILES

C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(N1C=O)C3=CC=CC=C3

InChI

InChI=1S/C16H13N3O4/c20-10-18-9-15(21)17-14-7-6-12(19(22)23)8-13(14)16(18)11-4-2-1-3-5-11/h1-8,10,16H,9H2,(H,17,21)