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

Systemtic Name: 2-chloranyl-N-[4-[4-[2-(3-methylphenyl)ethanoyl]piperazin-1-yl]phenyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[4-[4-[2-(m-tolyl)acetyl]piperazin-1-yl]phenyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[4-[4-[2-(3-methylphenyl)-1-oxoethyl]-1-piperazinyl]phenyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[4-[4-[2-(3-methylphenyl)acetyl]piperazin-1-yl]phenyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[4-[4-[2-(m-tolyl)acetyl]piperazino]phenyl]-4-nitro-benzamide Formula: C26H25ClN4O4 MolecularWeight: 492.9541

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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=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

InChI=1S/C26H25ClN4O4/c1-18-3-2-4-19(15-18)16-25(32)30-13-11-29(12-14-30)21-7-5-20(6-8-21)28-26(33)23-10-9-22(31(34)35)17-24(23)27/h2-10,15,17H,11-14,16H2,1H3,(H,28,33)