5-(4-methylphenyl)sulfanylfuran-2-carboxylic acid

Systemtic Name: 5-(4-methylphenyl)sulfanylfuran-2-carboxylic acid Openeye Name: 5-(p-tolylsulfanyl)furan-2-carboxylic acid CAS Name: 5-[(4-methylphenyl)thio]-2-furancarboxylic acid IUPAC Name: 5-(4-methylphenyl)sulfanylfuran-2-carboxylic acid Traditional Name: 5-(p-tolylthio)-2-furoic acid Formula: C12H10O3S MolecularWeight: 234.271

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CC=C(O2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CC=C(O2)C(=O)O

InChI

InChI=1S/C12H10O3S/c1-8-2-4-9(5-3-8)16-11-7-6-10(15-11)12(13)14/h2-7H,1H3,(H,13,14)