3-(3-fluorophenyl)sulfanyl-4-methyl-benzoic acid

Systemtic Name: 3-(3-fluorophenyl)sulfanyl-4-methyl-benzoic acid Openeye Name: 3-(3-fluorophenyl)sulfanyl-4-methyl-benzoic acid CAS Name: 3-[(3-fluorophenyl)thio]-4-methylbenzoic acid IUPAC Name: 3-(3-fluorophenyl)sulfanyl-4-methylbenzoic acid Traditional Name: 3-[(3-fluorophenyl)thio]-4-methyl-benzoic acid Formula: C14H11FO2S MolecularWeight: 262.299343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)SC2=CC=CC(=C2)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)SC2=CC=CC(=C2)F

InChI

InChI=1S/C14H11FO2S/c1-9-5-6-10(14(16)17)7-13(9)18-12-4-2-3-11(15)8-12/h2-8H,1H3,(H,16,17)