2-[1-(4-methoxyphenyl)-3-oxidanylidene-3-phenyl-propyl]sulfanylethanoic acid

Systemtic Name: 2-[1-(4-methoxyphenyl)-3-oxidanylidene-3-phenyl-propyl]sulfanylethanoic acid Openeye Name: 2-[1-(4-methoxyphenyl)-3-oxo-3-phenyl-propyl]sulfanylacetic acid CAS Name: 2-[[1-(4-methoxyphenyl)-3-oxo-3-phenylpropyl]thio]acetic acid IUPAC Name: 2-[1-(4-methoxyphenyl)-3-oxo-3-phenylpropyl]sulfanylacetic acid Traditional Name: 2-[[3-keto-1-(4-methoxyphenyl)-3-phenyl-propyl]thio]acetic acid Formula: C18H18O4S MolecularWeight: 330.39812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18O4S/c1-22-15-9-7-14(8-10-15)17(23-12-18(20)21)11-16(19)13-5-3-2-4-6-13/h2-10,17H,11-12H2,1H3,(H,20,21)