4-[(2-methylphenyl)methyl]-N-[(4-methylphenyl)methyl]piperazin-4-ium-1-carboxamide

Systemtic Name: 4-[(2-methylphenyl)methyl]-N-[(4-methylphenyl)methyl]piperazin-4-ium-1-carboxamide Openeye Name: 4-(o-tolylmethyl)-N-(p-tolylmethyl)piperazin-4-ium-1-carboxamide CAS Name: 4-[(2-methylphenyl)methyl]-N-[(4-methylphenyl)methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[(2-methylphenyl)methyl]-N-[(4-methylphenyl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: 4-(2-methylbenzyl)-N-(4-methylbenzyl)piperazin-4-ium-1-carboxamide Formula: C21H28N3O+ MolecularWeight: 338.46652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)N2CC[NH+](CC2)CC3=CC=CC=C3C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)N2CC[NH+](CC2)CC3=CC=CC=C3C

InChI

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