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

Systemtic Name: 4-(carboxymethyl)-3-(4-fluorophenyl)sulfanyl-benzoic acid Openeye Name: 4-(carboxymethyl)-3-(4-fluorophenyl)sulfanyl-benzoic acid CAS Name: 4-(carboxymethyl)-3-[(4-fluorophenyl)thio]benzoic acid IUPAC Name: 4-(carboxymethyl)-3-(4-fluorophenyl)sulfanylbenzoic acid Traditional Name: 4-(carboxymethyl)-3-[(4-fluorophenyl)thio]benzoic acid Formula: C15H11FO4S MolecularWeight: 306.308843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1F)SC2=C(C=CC(=C2)C(=O)O)CC(=O)O

Isomeric SMILES

C1=CC(=CC=C1F)SC2=C(C=CC(=C2)C(=O)O)CC(=O)O

InChI

InChI=1S/C15H11FO4S/c16-11-3-5-12(6-4-11)21-13-7-10(15(19)20)2-1-9(13)8-14(17)18/h1-7H,8H2,(H,17,18)(H,19,20)