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

Systemtic Name: N-[4-[4-[2-(3-methylphenyl)ethanoyl]piperazin-1-yl]phenyl]-3-nitro-benzamide Openeye Name: N-[4-[4-[2-(m-tolyl)acetyl]piperazin-1-yl]phenyl]-3-nitro-benzamide CAS Name: N-[4-[4-[2-(3-methylphenyl)-1-oxoethyl]-1-piperazinyl]phenyl]-3-nitrobenzamide IUPAC Name: N-[4-[4-[2-(3-methylphenyl)acetyl]piperazin-1-yl]phenyl]-3-nitrobenzamide Traditional Name: N-[4-[4-[2-(m-tolyl)acetyl]piperazino]phenyl]-3-nitro-benzamide Formula: C26H26N4O4 MolecularWeight: 458.50904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26N4O4/c1-19-4-2-5-20(16-19)17-25(31)29-14-12-28(13-15-29)23-10-8-22(9-11-23)27-26(32)21-6-3-7-24(18-21)30(33)34/h2-11,16,18H,12-15,17H2,1H3,(H,27,32)