1-methylsulfanyl-2-[(Z)-oct-2-en-3-yl]pyridin-1-ium chloride

Systemtic Name: 1-methylsulfanyl-2-[(Z)-oct-2-en-3-yl]pyridin-1-ium chloride Openeye Name: 2-[(1Z)-1-ethylidenehexyl]-1-methylsulfanyl-pyridin-1-ium chloride CAS Name: 1-(methylthio)-2-[(Z)-oct-2-en-3-yl]pyridin-1-ium chloride IUPAC Name: 1-methylsulfanyl-2-[(Z)-oct-2-en-3-yl]pyridin-1-ium chloride Traditional Name: 2-[(Z)-1-amylprop-1-enyl]-1-(methylthio)pyridin-1-ium chloride Formula: C14H22ClNS MolecularWeight: 271.84918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=CC)C1=CC=CC=[N+]1SC.[Cl-]

Isomeric SMILES

CCCCC/C(=C/C)/C1=CC=CC=[N+]1SC.[Cl-]

InChI

InChI=1S/C14H22NS.ClH/c1-4-6-7-10-13(5-2)14-11-8-9-12-15(14)16-3;/h5,8-9,11-12H,4,6-7,10H2,1-3H3;1H/q+1;/p-1/b13-5-;