3-methyl-N-(4-methylphenyl)-4-piperazin-4-ium-1-yl-benzamide

Systemtic Name: 3-methyl-N-(4-methylphenyl)-4-piperazin-4-ium-1-yl-benzamide Openeye Name: 3-methyl-4-piperazin-4-ium-1-yl-N-(p-tolyl)benzamide CAS Name: 3-methyl-N-(4-methylphenyl)-4-(1-piperazin-4-iumyl)benzamide IUPAC Name: 3-methyl-N-(4-methylphenyl)-4-piperazin-4-ium-1-ylbenzamide Traditional Name: 3-methyl-4-piperazin-4-ium-1-yl-N-(p-tolyl)benzamide Formula: C19H24N3O+ MolecularWeight: 310.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CC[NH2+]CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CC[NH2+]CC3)C

InChI

InChI=1S/C19H23N3O/c1-14-3-6-17(7-4-14)21-19(23)16-5-8-18(15(2)13-16)22-11-9-20-10-12-22/h3-8,13,20H,9-12H2,1-2H3,(H,21,23)/p+1