2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[2-(2-methylphenyl)ethyl]ethanamide

Systemtic Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[2-(2-methylphenyl)ethyl]ethanamide Openeye Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[2-(o-tolyl)ethyl]acetamide CAS Name: 2-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]-N-[2-(2-methylphenyl)ethyl]acetamide IUPAC Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[2-(2-methylphenyl)ethyl]acetamide Traditional Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-[2-(o-tolyl)ethyl]acetamide Formula: C21H27ClN3O+ MolecularWeight: 372.91158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCNC(=O)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1CCNC(=O)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H26ClN3O/c1-17-5-2-3-6-18(17)9-10-23-21(26)16-24-11-13-25(14-12-24)20-8-4-7-19(22)15-20/h2-8,15H,9-14,16H2,1H3,(H,23,26)/p+1