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

Systemtic Name: 4-[[4-[(3-methylphenyl)methyl]piperazin-1-yl]methyl]-3-nitro-benzamide Openeye Name: 4-[[4-(m-tolylmethyl)piperazin-1-yl]methyl]-3-nitro-benzamide CAS Name: 4-[[4-[(3-methylphenyl)methyl]-1-piperazinyl]methyl]-3-nitrobenzamide IUPAC Name: 4-[[4-[(3-methylphenyl)methyl]piperazin-1-yl]methyl]-3-nitrobenzamide Traditional Name: 4-[[4-(3-methylbenzyl)piperazino]methyl]-3-nitro-benzamide Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)CC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)CC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O3/c1-15-3-2-4-16(11-15)13-22-7-9-23(10-8-22)14-18-6-5-17(20(21)25)12-19(18)24(26)27/h2-6,11-12H,7-10,13-14H2,1H3,(H2,21,25)