2-naphthalen-1-yl-1-[4-(2-pyridin-2-ylethyl)piperazin-4-ium-1-yl]ethanone chloride

Systemtic Name: 2-naphthalen-1-yl-1-[4-(2-pyridin-2-ylethyl)piperazin-4-ium-1-yl]ethanone chloride Openeye Name: 2-(1-naphthyl)-1-[4-[2-(2-pyridyl)ethyl]piperazin-4-ium-1-yl]ethanone chloride CAS Name: 2-(1-naphthalenyl)-1-[4-[2-(2-pyridinyl)ethyl]-1-piperazin-4-iumyl]ethanone chloride IUPAC Name: 2-naphthalen-1-yl-1-[4-(2-pyridin-2-ylethyl)piperazin-4-ium-1-yl]ethanone chloride Traditional Name: 2-(1-naphthyl)-1-[4-[2-(2-pyridyl)ethyl]piperazin-4-ium-1-yl]ethanone chloride Formula: C23H26ClN3O MolecularWeight: 395.92504

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC2=CC=CC=N2)C(=O)CC3=CC=CC4=CC=CC=C43.[Cl-]

Isomeric SMILES

C1CN(CC[NH+]1CCC2=CC=CC=N2)C(=O)CC3=CC=CC4=CC=CC=C43.[Cl-]

InChI

InChI=1S/C23H25N3O.ClH/c27-23(18-20-8-5-7-19-6-1-2-10-22(19)20)26-16-14-25(15-17-26)13-11-21-9-3-4-12-24-21;/h1-10,12H,11,13-18H2;1H