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

Systemtic Name: 4-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-N-(3-methylphenyl)-3-nitro-benzamide Openeye Name: 4-[3-methyl-4-(m-tolyl)piperazin-1-yl]-N-(m-tolyl)-3-nitro-benzamide CAS Name: 4-[3-methyl-4-(3-methylphenyl)-1-piperazinyl]-N-(3-methylphenyl)-3-nitrobenzamide IUPAC Name: 4-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-N-(3-methylphenyl)-3-nitrobenzamide Traditional Name: 4-[3-methyl-4-(m-tolyl)piperazino]-N-(m-tolyl)-3-nitro-benzamide Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)C3=C(C=C(C=C3)C(=O)NC4=CC=CC(=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)C3=C(C=C(C=C3)C(=O)NC4=CC=CC(=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C26H28N4O3/c1-18-6-4-8-22(14-18)27-26(31)21-10-11-24(25(16-21)30(32)33)28-12-13-29(20(3)17-28)23-9-5-7-19(2)15-23/h4-11,14-16,20H,12-13,17H2,1-3H3,(H,27,31)