(4-methyl-2-oxidanylidene-pyridin-1-yl) 4-methylbenzenesulfonate

Systemtic Name: (4-methyl-2-oxidanylidene-pyridin-1-yl) 4-methylbenzenesulfonate Openeye Name: (4-methyl-2-oxo-1-pyridyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (4-methyl-2-oxo-1-pyridinyl) ester IUPAC Name: (4-methyl-2-oxopyridin-1-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-keto-4-methyl-1-pyridyl) ester Formula: C13H13NO4S MolecularWeight: 279.31162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ON2C=CC(=CC2=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)ON2C=CC(=CC2=O)C

InChI

InChI=1S/C13H13NO4S/c1-10-3-5-12(6-4-10)19(16,17)18-14-8-7-11(2)9-13(14)15/h3-9H,1-2H3