4-(4-methoxyphenyl)-2-(4-methylphenyl)sulfanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(4-methoxyphenyl)-2-(4-methylphenyl)sulfanyl-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-methoxyphenyl)-4-oxo-2-(p-tolylsulfanyl)butanoic acid CAS Name: 4-(4-methoxyphenyl)-2-[(4-methylphenyl)thio]-4-oxobutanoic acid IUPAC Name: 4-(4-methoxyphenyl)-2-(4-methylphenyl)sulfanyl-4-oxobutanoic acid Traditional Name: 4-keto-4-(4-methoxyphenyl)-2-(p-tolylthio)butyric acid Formula: C18H18O4S MolecularWeight: 330.39812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(CC(=O)C2=CC=C(C=C2)OC)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)SC(CC(=O)C2=CC=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C18H18O4S/c1-12-3-9-15(10-4-12)23-17(18(20)21)11-16(19)13-5-7-14(22-2)8-6-13/h3-10,17H,11H2,1-2H3,(H,20,21)