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

Systemtic Name: N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-2-phenoxy-ethanamide Openeye Name: N-[2-[4-(m-tolyl)piperazin-1-ium-1-yl]ethyl]-2-phenoxy-acetamide CAS Name: N-[2-[4-(3-methylphenyl)-1-piperazin-1-iumyl]ethyl]-2-phenoxyacetamide IUPAC Name: N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-2-phenoxyacetamide Traditional Name: N-[2-[4-(m-tolyl)piperazin-1-ium-1-yl]ethyl]-2-phenoxy-acetamide Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCNC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCNC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C21H27N3O2/c1-18-6-5-7-19(16-18)24-14-12-23(13-15-24)11-10-22-21(25)17-26-20-8-3-2-4-9-20/h2-9,16H,10-15,17H2,1H3,(H,22,25)/p+1