3-oxidanylidene-4-phenyl-2-sulfanyl-butanoic acid

Systemtic Name: 3-oxidanylidene-4-phenyl-2-sulfanyl-butanoic acid Openeye Name: 3-oxo-4-phenyl-2-sulfanyl-butanoic acid CAS Name: 2-mercapto-3-oxo-4-phenylbutanoic acid IUPAC Name: 3-oxo-4-phenyl-2-sulfanylbutanoic acid Traditional Name: 3-keto-2-mercapto-4-phenyl-butyric acid Formula: C10H10O3S MolecularWeight: 210.2496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)C(C(=O)O)S

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)C(C(=O)O)S

InChI

InChI=1S/C10H10O3S/c11-8(9(14)10(12)13)6-7-4-2-1-3-5-7/h1-5,9,14H,6H2,(H,12,13)