(3-methyl-5-oxidanyl-phenyl) 3-methylbenzenesulfonate

Systemtic Name: (3-methyl-5-oxidanyl-phenyl) 3-methylbenzenesulfonate Openeye Name: (3-hydroxy-5-methyl-phenyl) 3-methylbenzenesulfonate CAS Name: 3-methylbenzenesulfonic acid (3-hydroxy-5-methylphenyl) ester IUPAC Name: (3-hydroxy-5-methylphenyl) 3-methylbenzenesulfonate Traditional Name: 3-methylbenzenesulfonic acid (3-hydroxy-5-methyl-phenyl) ester Formula: C14H14O4S MolecularWeight: 278.32356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14O4S/c1-10-4-3-5-14(8-10)19(16,17)18-13-7-11(2)6-12(15)9-13/h3-9,15H,1-2H3