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

Systemtic Name: 2-[3-(2,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-3-oxidanylidene-propyl]sulfanylethanoic acid Openeye Name: 2-[3-(2,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-3-oxo-propyl]sulfanylacetic acid CAS Name: 2-[[3-(2,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-3-oxopropyl]thio]acetic acid IUPAC Name: 2-[3-(2,4-dimethoxyphenyl)-1-(4-methoxyphenyl)-3-oxopropyl]sulfanylacetic acid Traditional Name: 2-[[3-(2,4-dimethoxyphenyl)-3-keto-1-(4-methoxyphenyl)propyl]thio]acetic acid Formula: C20H22O6S MolecularWeight: 390.45008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22O6S/c1-24-14-6-4-13(5-7-14)19(27-12-20(22)23)11-17(21)16-9-8-15(25-2)10-18(16)26-3/h4-10,19H,11-12H2,1-3H3,(H,22,23)