(phenylmethyl) 4-methylbenzenesulfonate

Systemtic Name: (phenylmethyl) 4-methylbenzenesulfonate Openeye Name: benzyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (phenylmethyl) ester IUPAC Name: benzyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid benzyl ester Formula: C14H14O3S MolecularWeight: 262.32416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C14H14O3S/c1-12-7-9-14(10-8-12)18(15,16)17-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3