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

Systemtic Name: N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-2-naphthalen-1-yl-ethanamide Openeye Name: N-[2-[4-(m-tolyl)piperazin-1-ium-1-yl]ethyl]-2-(1-naphthyl)acetamide CAS Name: N-[2-[4-(3-methylphenyl)-1-piperazin-1-iumyl]ethyl]-2-(1-naphthalenyl)acetamide IUPAC Name: N-[2-[4-(3-methylphenyl)piperazin-1-ium-1-yl]ethyl]-2-naphthalen-1-ylacetamide Traditional Name: N-[2-[4-(m-tolyl)piperazin-1-ium-1-yl]ethyl]-2-(1-naphthyl)acetamide Formula: C25H30N3O+ MolecularWeight: 388.5252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCNC(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCNC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H29N3O/c1-20-6-4-10-23(18-20)28-16-14-27(15-17-28)13-12-26-25(29)19-22-9-5-8-21-7-2-3-11-24(21)22/h2-11,18H,12-17,19H2,1H3,(H,26,29)/p+1