3-[(2-fluorophenyl)methylsulfonyl]-4-methyl-benzoic acid

Systemtic Name: 3-[(2-fluorophenyl)methylsulfonyl]-4-methyl-benzoic acid Openeye Name: 3-[(2-fluorophenyl)methylsulfonyl]-4-methyl-benzoic acid CAS Name: 3-[(2-fluorophenyl)methylsulfonyl]-4-methylbenzoic acid IUPAC Name: 3-[(2-fluorophenyl)methylsulfonyl]-4-methylbenzoic acid Traditional Name: 3-(2-fluorobenzyl)sulfonyl-4-methyl-benzoic acid Formula: C15H13FO4S MolecularWeight: 308.324723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)CC2=CC=CC=C2F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)CC2=CC=CC=C2F

InChI

InChI=1S/C15H13FO4S/c1-10-6-7-11(15(17)18)8-14(10)21(19,20)9-12-4-2-3-5-13(12)16/h2-8H,9H2,1H3,(H,17,18)