2-[2,5-dimethoxy-4-(phenylcarbonyl)phenyl]carbonylsulfanylethanoic acid

Systemtic Name: 2-[2,5-dimethoxy-4-(phenylcarbonyl)phenyl]carbonylsulfanylethanoic acid Openeye Name: 2-(4-benzoyl-2,5-dimethoxy-benzoyl)sulfanylacetic acid CAS Name: 2-[[(4-benzoyl-2,5-dimethoxyphenyl)-oxomethyl]thio]acetic acid IUPAC Name: 2-(4-benzoyl-2,5-dimethoxybenzoyl)sulfanylacetic acid Traditional Name: 2-[(4-benzoyl-2,5-dimethoxy-benzoyl)thio]acetic acid Formula: C18H16O6S MolecularWeight: 360.38104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)C2=CC=CC=C2)OC)C(=O)SCC(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)C2=CC=CC=C2)OC)C(=O)SCC(=O)O

InChI

InChI=1S/C18H16O6S/c1-23-14-9-13(18(22)25-10-16(19)20)15(24-2)8-12(14)17(21)11-6-4-3-5-7-11/h3-9H,10H2,1-2H3,(H,19,20)