1-[3-(3-methoxyphenyl)prop-2-ynyl]-3-methyl-piperidin-1-ium chloride

Systemtic Name: 1-[3-(3-methoxyphenyl)prop-2-ynyl]-3-methyl-piperidin-1-ium chloride Openeye Name: 1-[3-(3-methoxyphenyl)prop-2-ynyl]-3-methyl-piperidin-1-ium chloride CAS Name: 1-[3-(3-methoxyphenyl)prop-2-ynyl]-3-methylpiperidin-1-ium chloride IUPAC Name: 1-[3-(3-methoxyphenyl)prop-2-ynyl]-3-methylpiperidin-1-ium chloride Traditional Name: 1-[3-(3-methoxyphenyl)prop-2-ynyl]-3-methyl-piperidin-1-ium chloride Formula: C16H22ClNO MolecularWeight: 279.80498

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC#CC2=CC(=CC=C2)OC.[Cl-]

Isomeric SMILES

CC1CCC[NH+](C1)CC#CC2=CC(=CC=C2)OC.[Cl-]

InChI

InChI=1S/C16H21NO.ClH/c1-14-6-4-10-17(13-14)11-5-8-15-7-3-9-16(12-15)18-2;/h3,7,9,12,14H,4,6,10-11,13H2,1-2H3;1H