ethyl 2-(4-methylpyridin-1-ium-1-yl)-3,3-bis(methylsulfanyl)prop-2-enoate

Systemtic Name: ethyl 2-(4-methylpyridin-1-ium-1-yl)-3,3-bis(methylsulfanyl)prop-2-enoate Openeye Name: ethyl 2-(4-methylpyridin-1-ium-1-yl)-3,3-bis(methylsulfanyl)prop-2-enoate CAS Name: 2-(4-methyl-1-pyridin-1-iumyl)-3,3-bis(methylthio)-2-propenoic acid ethyl ester IUPAC Name: ethyl 2-(4-methylpyridin-1-ium-1-yl)-3,3-bis(methylsulfanyl)prop-2-enoate Traditional Name: 2-(4-methylpyridin-1-ium-1-yl)-3,3-bis(methylthio)acrylic acid ethyl ester Formula: C13H18NO2S2+ MolecularWeight: 284.41752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(SC)SC)[N+]1=CC=C(C=C1)C

Isomeric SMILES

CCOC(=O)C(=C(SC)SC)[N+]1=CC=C(C=C1)C

InChI

InChI=1S/C13H18NO2S2/c1-5-16-12(15)11(13(17-3)18-4)14-8-6-10(2)7-9-14/h6-9H,5H2,1-4H3/q+1