(6-methylpyridin-2-yl) 4-methylbenzenesulfonate

Systemtic Name: (6-methylpyridin-2-yl) 4-methylbenzenesulfonate Openeye Name: (6-methyl-2-pyridyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (6-methyl-2-pyridinyl) ester IUPAC Name: (6-methylpyridin-2-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (6-methyl-2-pyridyl) ester Formula: C13H13NO3S MolecularWeight: 263.31222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=N2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=N2)C

InChI

InChI=1S/C13H13NO3S/c1-10-6-8-12(9-7-10)18(15,16)17-13-5-3-4-11(2)14-13/h3-9H,1-2H3