phenyl 3-methylbenzenesulfonate

Systemtic Name: phenyl 3-methylbenzenesulfonate Openeye Name: phenyl 3-methylbenzenesulfonate CAS Name: 3-methylbenzenesulfonic acid phenyl ester IUPAC Name: phenyl 3-methylbenzenesulfonate Traditional Name: 3-methylbenzenesulfonic acid phenyl ester Formula: C13H12O3S MolecularWeight: 248.29758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12O3S/c1-11-6-5-9-13(10-11)17(14,15)16-12-7-3-2-4-8-12/h2-10H,1H3