1-(4-nitrophenyl)carbonyl-3,4-dihydro-2H-1,4-benzodiazepin-5-one

Systemtic Name: 1-(4-nitrophenyl)carbonyl-3,4-dihydro-2H-1,4-benzodiazepin-5-one Openeye Name: 1-(4-nitrobenzoyl)-3,4-dihydro-2H-1,4-benzodiazepin-5-one CAS Name: 1-[(4-nitrophenyl)-oxomethyl]-3,4-dihydro-2H-1,4-benzodiazepin-5-one IUPAC Name: 1-(4-nitrobenzoyl)-3,4-dihydro-2H-1,4-benzodiazepin-5-one Traditional Name: 1-(4-nitrobenzoyl)-3,4-dihydro-2H-1,4-benzodiazepin-5-one Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2C(=O)N1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(C2=CC=CC=C2C(=O)N1)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O4/c20-15-13-3-1-2-4-14(13)18(10-9-17-15)16(21)11-5-7-12(8-6-11)19(22)23/h1-8H,9-10H2,(H,17,20)