4-methyl-5-[2-[(3-nitrophenyl)amino]ethanoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: 4-methyl-5-[2-[(3-nitrophenyl)amino]ethanoyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: 4-methyl-5-[2-(3-nitroanilino)acetyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: 4-methyl-5-[2-(3-nitroanilino)-1-oxoethyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: 4-methyl-5-[2-(3-nitroanilino)acetyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: 4-methyl-5-[2-(3-nitroanilino)acetyl]-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CNC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CNC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O4/c1-12-9-17(23)20-15-7-2-3-8-16(15)21(12)18(24)11-19-13-5-4-6-14(10-13)22(25)26/h2-8,10,12,19H,9,11H2,1H3,(H,20,23)