7,8-dimethyl-5-(4-nitrophenyl)carbonyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: 7,8-dimethyl-5-(4-nitrophenyl)carbonyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: 7,8-dimethyl-5-(4-nitrobenzoyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: 7,8-dimethyl-5-[(4-nitrophenyl)-oxomethyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: 7,8-dimethyl-5-(4-nitrobenzoyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: 7,8-dimethyl-5-(4-nitrobenzoyl)-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(CCC(=O)N2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1C)N(CCC(=O)N2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O4/c1-11-9-15-16(10-12(11)2)20(8-7-17(22)19-15)18(23)13-3-5-14(6-4-13)21(24)25/h3-6,9-10H,7-8H2,1-2H3,(H,19,22)