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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C)C(=O)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN(C)C(=O)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H26ClN3O/c1-17-6-8-18(9-7-17)15-23(2)21(26)16-24-10-12-25(13-11-24)20-5-3-4-19(22)14-20/h3-9,14H,10-13,15-16H2,1-2H3/p+1