5-fluoranyl-2-(phenylmethyl)sulfonyl-benzoic acid

Systemtic Name: 5-fluoranyl-2-(phenylmethyl)sulfonyl-benzoic acid Openeye Name: 2-benzylsulfonyl-5-fluoro-benzoic acid CAS Name: 5-fluoro-2-(phenylmethyl)sulfonylbenzoic acid IUPAC Name: 2-benzylsulfonyl-5-fluorobenzoic acid Traditional Name: 2-benzylsulfonyl-5-fluoro-benzoic acid Formula: C14H11FO4S MolecularWeight: 294.298143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)C2=C(C=C(C=C2)F)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)C2=C(C=C(C=C2)F)C(=O)O

InChI

InChI=1S/C14H11FO4S/c15-11-6-7-13(12(8-11)14(16)17)20(18,19)9-10-4-2-1-3-5-10/h1-8H,9H2,(H,16,17)