1-(2-methylprop-2-enyl)-1-(3-naphthalen-1-ylprop-2-ynyl)piperidin-1-ium chloride

Systemtic Name: 1-(2-methylprop-2-enyl)-1-(3-naphthalen-1-ylprop-2-ynyl)piperidin-1-ium chloride Openeye Name: 1-(2-methylallyl)-1-[3-(1-naphthyl)prop-2-ynyl]piperidin-1-ium chloride CAS Name: 1-(2-methylprop-2-enyl)-1-[3-(1-naphthalenyl)prop-2-ynyl]piperidin-1-ium chloride IUPAC Name: 1-(2-methylprop-2-enyl)-1-(3-naphthalen-1-ylprop-2-ynyl)piperidin-1-ium chloride Traditional Name: 1-(2-methylallyl)-1-[3-(1-naphthyl)prop-2-ynyl]piperidin-1-ium chloride Formula: C22H26ClN MolecularWeight: 339.90154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C[N+]1(CCCCC1)CC#CC2=CC=CC3=CC=CC=C32.[Cl-]

Isomeric SMILES

CC(=C)C[N+]1(CCCCC1)CC#CC2=CC=CC3=CC=CC=C32.[Cl-]

InChI

InChI=1S/C22H26N.ClH/c1-19(2)18-23(15-6-3-7-16-23)17-9-13-21-12-8-11-20-10-4-5-14-22(20)21;/h4-5,8,10-12,14H,1,3,6-7,15-18H2,2H3;1H/q+1;/p-1