[(3-fluorophenyl)-phenyl-methyl] 4-methylbenzenesulfonate

Systemtic Name: [(3-fluorophenyl)-phenyl-methyl] 4-methylbenzenesulfonate Openeye Name: [(3-fluorophenyl)-phenyl-methyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(3-fluorophenyl)-phenylmethyl] ester IUPAC Name: [(3-fluorophenyl)-phenylmethyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(3-fluorophenyl)-phenyl-methyl] ester Formula: C20H17FO3S MolecularWeight: 356.410583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C2=CC=CC=C2)C3=CC(=CC=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(C2=CC=CC=C2)C3=CC(=CC=C3)F

InChI

InChI=1S/C20H17FO3S/c1-15-10-12-19(13-11-15)25(22,23)24-20(16-6-3-2-4-7-16)17-8-5-9-18(21)14-17/h2-14,20H,1H3