1-(3-methoxy-4-nitro-phenyl)carbonyl-7-methyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one

Systemtic Name: 1-(3-methoxy-4-nitro-phenyl)carbonyl-7-methyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 1-(3-methoxy-4-nitro-benzoyl)-7-methyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 1-[(3-methoxy-4-nitrophenyl)-oxomethyl]-7-methyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 1-(3-methoxy-4-nitrobenzoyl)-7-methyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 1-(3-methoxy-4-nitro-benzoyl)-7-methyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C18H17N3O5 MolecularWeight: 355.34468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(CCC(=O)N2)C(=O)C3=CC(=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC2=C(C=C1)N(CCC(=O)N2)C(=O)C3=CC(=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H17N3O5/c1-11-3-5-14-13(9-11)19-17(22)7-8-20(14)18(23)12-4-6-15(21(24)25)16(10-12)26-2/h3-6,9-10H,7-8H2,1-2H3,(H,19,22)