4-(4-methoxyphenyl)-4-oxidanylidene-2-phenylsulfanyl-butanoic acid

Systemtic Name: 4-(4-methoxyphenyl)-4-oxidanylidene-2-phenylsulfanyl-butanoic acid Openeye Name: 4-(4-methoxyphenyl)-4-oxo-2-phenylsulfanyl-butanoic acid CAS Name: 4-(4-methoxyphenyl)-4-oxo-2-(phenylthio)butanoic acid IUPAC Name: 4-(4-methoxyphenyl)-4-oxo-2-phenylsulfanylbutanoic acid Traditional Name: 4-keto-4-(4-methoxyphenyl)-2-(phenylthio)butyric acid Formula: C17H16O4S MolecularWeight: 316.37154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CC(C(=O)O)SC2=CC=CC=C2

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CC(C(=O)O)SC2=CC=CC=C2

InChI

InChI=1S/C17H16O4S/c1-21-13-9-7-12(8-10-13)15(18)11-16(17(19)20)22-14-5-3-2-4-6-14/h2-10,16H,11H2,1H3,(H,19,20)