4-(4-ethanoylpiperazin-1-yl)-N-(2-methyl-3-nitro-phenyl)-4-oxidanylidene-butanamide

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)-N-(2-methyl-3-nitro-phenyl)-4-oxidanylidene-butanamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-(2-methyl-3-nitro-phenyl)-4-oxo-butanamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-(2-methyl-3-nitrophenyl)-4-oxobutanamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-(2-methyl-3-nitrophenyl)-4-oxobutanamide Traditional Name: 4-(4-acetylpiperazino)-4-keto-N-(2-methyl-3-nitro-phenyl)butyramide Formula: C17H22N4O5 MolecularWeight: 362.38038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CCC(=O)N2CCN(CC2)C(=O)C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CCC(=O)N2CCN(CC2)C(=O)C

InChI

InChI=1S/C17H22N4O5/c1-12-14(4-3-5-15(12)21(25)26)18-16(23)6-7-17(24)20-10-8-19(9-11-20)13(2)22/h3-5H,6-11H2,1-2H3,(H,18,23)