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

Systemtic Name: N-[(2-methylphenyl)methyl]-2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(m-tolyl)piperazin-1-ium-1-yl]-N-(o-tolylmethyl)acetamide CAS Name: N-[(2-methylphenyl)methyl]-2-[4-(3-methylphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(2-methylphenyl)methyl]-2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-methylbenzyl)-2-[4-(m-tolyl)piperazin-1-ium-1-yl]acetamide Formula: C21H28N3O+ MolecularWeight: 338.46652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC[NH+](CC2)CC(=O)NCC3=CC=CC=C3C

Isomeric SMILES

CC1=CC(=CC=C1)N2CC[NH+](CC2)CC(=O)NCC3=CC=CC=C3C

InChI

InChI=1S/C21H27N3O/c1-17-6-5-9-20(14-17)24-12-10-23(11-13-24)16-21(25)22-15-19-8-4-3-7-18(19)2/h3-9,14H,10-13,15-16H2,1-2H3,(H,22,25)/p+1