4-[4-(4-methylsulfanylphenyl)phenyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(4-methylsulfanylphenyl)phenyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(4-methylsulfanylphenyl)phenyl]-4-oxo-butanoic acid CAS Name: 4-[4-[4-(methylthio)phenyl]phenyl]-4-oxobutanoic acid IUPAC Name: 4-[4-(4-methylsulfanylphenyl)phenyl]-4-oxobutanoic acid Traditional Name: 4-keto-4-[4-[4-(methylthio)phenyl]phenyl]butyric acid Formula: C17H16O3S MolecularWeight: 300.37214

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CCC(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CCC(=O)O

InChI

InChI=1S/C17H16O3S/c1-21-15-8-6-13(7-9-15)12-2-4-14(5-3-12)16(18)10-11-17(19)20/h2-9H,10-11H2,1H3,(H,19,20)