(2-methylphenyl) 2-chloranyl-4-fluoranyl-benzenesulfonate

Systemtic Name: (2-methylphenyl) 2-chloranyl-4-fluoranyl-benzenesulfonate Openeye Name: o-tolyl 2-chloro-4-fluoro-benzenesulfonate CAS Name: 2-chloro-4-fluorobenzenesulfonic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) 2-chloro-4-fluorobenzenesulfonate Traditional Name: 2-chloro-4-fluoro-benzenesulfonic acid o-tolyl ester Formula: C13H10ClFO3S MolecularWeight: 300.733103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OS(=O)(=O)C2=C(C=C(C=C2)F)Cl

Isomeric SMILES

CC1=CC=CC=C1OS(=O)(=O)C2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C13H10ClFO3S/c1-9-4-2-3-5-12(9)18-19(16,17)13-7-6-10(15)8-11(13)14/h2-8H,1H3