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

Systemtic Name: N-(2-methylphenyl)-4-[(2-methylphenyl)methyl]piperazin-4-ium-1-carboxamide Openeye Name: N-(o-tolyl)-4-(o-tolylmethyl)piperazin-4-ium-1-carboxamide CAS Name: N-(2-methylphenyl)-4-[(2-methylphenyl)methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-(2-methylphenyl)-4-[(2-methylphenyl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: 4-(2-methylbenzyl)-N-(o-tolyl)piperazin-4-ium-1-carboxamide Formula: C20H26N3O+ MolecularWeight: 324.43994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)NC3=CC=CC=C3C

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)NC3=CC=CC=C3C

InChI

InChI=1S/C20H25N3O/c1-16-7-3-5-9-18(16)15-22-11-13-23(14-12-22)20(24)21-19-10-6-4-8-17(19)2/h3-10H,11-15H2,1-2H3,(H,21,24)/p+1