4-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfonyl]benzoate

Systemtic Name: 4-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfonyl]benzoate Openeye Name: 4-[(2-chloro-4-fluoro-phenyl)methylsulfonyl]benzoate CAS Name: 4-[(2-chloro-4-fluorophenyl)methylsulfonyl]benzoate IUPAC Name: 4-[(2-chloro-4-fluorophenyl)methylsulfonyl]benzoate Traditional Name: 4-(2-chloro-4-fluoro-benzyl)sulfonylbenzoate Formula: C14H9ClFO4S- MolecularWeight: 327.735263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)[O-])S(=O)(=O)CC2=C(C=C(C=C2)F)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)[O-])S(=O)(=O)CC2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C14H10ClFO4S/c15-13-7-11(16)4-1-10(13)8-21(19,20)12-5-2-9(3-6-12)14(17)18/h1-7H,8H2,(H,17,18)/p-1