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

Systemtic Name: 4-[(4-methoxyphenyl)methyl]-N-[(4-methylphenyl)methyl]piperazin-4-ium-1-carboxamide Openeye Name: 4-[(4-methoxyphenyl)methyl]-N-(p-tolylmethyl)piperazin-4-ium-1-carboxamide CAS Name: 4-[(4-methoxyphenyl)methyl]-N-[(4-methylphenyl)methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[(4-methoxyphenyl)methyl]-N-[(4-methylphenyl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: N-(4-methylbenzyl)-4-p-anisyl-piperazin-4-ium-1-carboxamide Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H27N3O2/c1-17-3-5-18(6-4-17)15-22-21(25)24-13-11-23(12-14-24)16-19-7-9-20(26-2)10-8-19/h3-10H,11-16H2,1-2H3,(H,22,25)/p+1