2-(5-ethanoylfuran-2-yl)sulfanylbenzoic acid

Systemtic Name: 2-(5-ethanoylfuran-2-yl)sulfanylbenzoic acid Openeye Name: 2-[(5-acetyl-2-furyl)sulfanyl]benzoic acid CAS Name: 2-[(5-acetyl-2-furanyl)thio]benzoic acid IUPAC Name: 2-(5-acetylfuran-2-yl)sulfanylbenzoic acid Traditional Name: 2-[(5-acetyl-2-furyl)thio]benzoic acid Formula: C13H10O4S MolecularWeight: 262.2811

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(O1)SC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(=O)C1=CC=C(O1)SC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C13H10O4S/c1-8(14)10-6-7-12(17-10)18-11-5-3-2-4-9(11)13(15)16/h2-7H,1H3,(H,15,16)