N-(4-methylphenyl)-4-phenethyl-piperazin-4-ium-1-carboxamide

Systemtic Name: N-(4-methylphenyl)-4-phenethyl-piperazin-4-ium-1-carboxamide Openeye Name: 4-phenethyl-N-(p-tolyl)piperazin-4-ium-1-carboxamide CAS Name: N-(4-methylphenyl)-4-phenethyl-1-piperazin-4-iumcarboxamide IUPAC Name: N-(4-methylphenyl)-4-phenethylpiperazin-4-ium-1-carboxamide Traditional Name: 4-phenethyl-N-(p-tolyl)piperazin-4-ium-1-carboxamide Formula: C20H26N3O+ MolecularWeight: 324.43994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C20H25N3O/c1-17-7-9-19(10-8-17)21-20(24)23-15-13-22(14-16-23)12-11-18-5-3-2-4-6-18/h2-10H,11-16H2,1H3,(H,21,24)/p+1