(2-chloranyl-4-fluoranyl-phenyl) 4-methylbenzenesulfonate

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl) 4-methylbenzenesulfonate Openeye Name: (2-chloro-4-fluoro-phenyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-chloro-4-fluorophenyl) ester IUPAC Name: (2-chloro-4-fluorophenyl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-chloro-4-fluoro-phenyl) ester Formula: C13H10ClFO3S MolecularWeight: 300.733103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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