(2-chloranyl-6-fluoranyl-phenyl)methyl 4-[(phenylmethyl)sulfonylmethyl]benzoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 4-[(phenylmethyl)sulfonylmethyl]benzoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 4-(benzylsulfonylmethyl)benzoate CAS Name: 4-[(phenylmethyl)sulfonylmethyl]benzoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 4-(benzylsulfonylmethyl)benzoate Traditional Name: 4-(benzylsulfonylmethyl)benzoic acid (2-chloro-6-fluoro-benzyl) ester Formula: C22H18ClFO4S MolecularWeight: 432.892323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)CC2=CC=C(C=C2)C(=O)OCC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)CC2=CC=C(C=C2)C(=O)OCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C22H18ClFO4S/c23-20-7-4-8-21(24)19(20)13-28-22(25)18-11-9-17(10-12-18)15-29(26,27)14-16-5-2-1-3-6-16/h1-12H,13-15H2