2-oxidanylidene-2-(4-propan-2-ylsulfanylphenyl)ethanoic acid

Systemtic Name: 2-oxidanylidene-2-(4-propan-2-ylsulfanylphenyl)ethanoic acid Openeye Name: 2-(4-isopropylsulfanylphenyl)-2-oxo-acetic acid CAS Name: 2-oxo-2-[4-(propan-2-ylthio)phenyl]acetic acid IUPAC Name: 2-oxo-2-(4-propan-2-ylsulfanylphenyl)acetic acid Traditional Name: 2-[4-(isopropylthio)phenyl]-2-keto-acetic acid Formula: C11H12O3S MolecularWeight: 224.27618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)C(=O)C(=O)O

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)C(=O)C(=O)O

InChI

InChI=1S/C11H12O3S/c1-7(2)15-9-5-3-8(4-6-9)10(12)11(13)14/h3-7H,1-2H3,(H,13,14)