4-methyl-N-[4-[4-[2-(3-methylphenyl)ethanoyl]piperazin-1-yl]phenyl]-3-nitro-benzamide

Systemtic Name: 4-methyl-N-[4-[4-[2-(3-methylphenyl)ethanoyl]piperazin-1-yl]phenyl]-3-nitro-benzamide Openeye Name: 4-methyl-N-[4-[4-[2-(m-tolyl)acetyl]piperazin-1-yl]phenyl]-3-nitro-benzamide CAS Name: 4-methyl-N-[4-[4-[2-(3-methylphenyl)-1-oxoethyl]-1-piperazinyl]phenyl]-3-nitrobenzamide IUPAC Name: 4-methyl-N-[4-[4-[2-(3-methylphenyl)acetyl]piperazin-1-yl]phenyl]-3-nitrobenzamide Traditional Name: 4-methyl-N-[4-[4-[2-(m-tolyl)acetyl]piperazino]phenyl]-3-nitro-benzamide Formula: C27H28N4O4 MolecularWeight: 472.53562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)CC(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C27H28N4O4/c1-19-4-3-5-21(16-19)17-26(32)30-14-12-29(13-15-30)24-10-8-23(9-11-24)28-27(33)22-7-6-20(2)25(18-22)31(34)35/h3-11,16,18H,12-15,17H2,1-2H3,(H,28,33)