(2-methyl-6-oxidanylidene-pyran-4-yl) 4-methylbenzenesulfonate

Systemtic Name: (2-methyl-6-oxidanylidene-pyran-4-yl) 4-methylbenzenesulfonate Openeye Name: (2-methyl-6-oxo-pyran-4-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-methyl-6-oxo-4-pyranyl) ester IUPAC Name: (2-methyl-6-oxopyran-4-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-keto-6-methyl-pyran-4-yl) ester Formula: C13H12O5S MolecularWeight: 280.29638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=O)OC(=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=O)OC(=C2)C

InChI

InChI=1S/C13H12O5S/c1-9-3-5-12(6-4-9)19(15,16)18-11-7-10(2)17-13(14)8-11/h3-8H,1-2H3