1-(1-methylpyridin-1-ium-4-yl)ethanesulfonic acid

Systemtic Name: 1-(1-methylpyridin-1-ium-4-yl)ethanesulfonic acid Openeye Name: 1-(1-methylpyridin-1-ium-4-yl)ethanesulfonic acid CAS Name: 1-(1-methyl-4-pyridin-1-iumyl)ethanesulfonic acid IUPAC Name: 1-(1-methylpyridin-1-ium-4-yl)ethanesulfonic acid Traditional Name: 1-(1-methylpyridin-1-ium-4-yl)ethanesulfonic acid Formula: C8H12NO3S+ MolecularWeight: 202.25078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=[N+](C=C1)C)S(=O)(=O)O

Isomeric SMILES

CC(C1=CC=[N+](C=C1)C)S(=O)(=O)O

InChI

InChI=1S/C8H11NO3S/c1-7(13(10,11)12)8-3-5-9(2)6-4-8/h3-7H,1-2H3/p+1