N-(4-methylphenyl)-2-[4-[2-(2-methylphenyl)ethanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[4-[2-(2-methylphenyl)ethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-[2-(o-tolyl)acetyl]piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[4-[2-(2-methylphenyl)-1-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-methylphenyl)-2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-[2-(o-tolyl)acetyl]piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)CC3=CC=CC=C3C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)CC3=CC=CC=C3C

InChI

InChI=1S/C22H27N3O2/c1-17-7-9-20(10-8-17)23-21(26)16-24-11-13-25(14-12-24)22(27)15-19-6-4-3-5-18(19)2/h3-10H,11-16H2,1-2H3,(H,23,26)/p+1