3-(5-ethenyl-2-methyl-pyridin-1-ium-1-yl)propane-1-sulfonate

Systemtic Name: 3-(5-ethenyl-2-methyl-pyridin-1-ium-1-yl)propane-1-sulfonate Openeye Name: 3-(2-methyl-5-vinyl-pyridin-1-ium-1-yl)propane-1-sulfonate CAS Name: 3-(5-ethenyl-2-methyl-1-pyridin-1-iumyl)-1-propanesulfonate IUPAC Name: 3-(5-ethenyl-2-methylpyridin-1-ium-1-yl)propane-1-sulfonate Traditional Name: 3-(2-methyl-5-vinyl-pyridin-1-ium-1-yl)propane-1-sulfonate Formula: C11H15NO3S MolecularWeight: 241.3067

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C=C1)C=C)CCCS(=O)(=O)[O-]

Isomeric SMILES

CC1=[N+](C=C(C=C1)C=C)CCCS(=O)(=O)[O-]

InChI

InChI=1S/C11H15NO3S/c1-3-11-6-5-10(2)12(9-11)7-4-8-16(13,14)15/h3,5-6,9H,1,4,7-8H2,2H3