2-[[4-methoxy-2-[(4-methoxyphenyl)methylsulfanyl]phenyl]methyl]-2-(2-methylpropyl)propanedioic acid

Systemtic Name: 2-[[4-methoxy-2-[(4-methoxyphenyl)methylsulfanyl]phenyl]methyl]-2-(2-methylpropyl)propanedioic acid Openeye Name: 2-isobutyl-2-[[4-methoxy-2-[(4-methoxyphenyl)methylsulfanyl]phenyl]methyl]propanedioic acid CAS Name: 2-[[4-methoxy-2-[(4-methoxyphenyl)methylthio]phenyl]methyl]-2-(2-methylpropyl)propanedioic acid IUPAC Name: 2-[[4-methoxy-2-[(4-methoxyphenyl)methylsulfanyl]phenyl]methyl]-2-(2-methylpropyl)propanedioic acid Traditional Name: 2-isobutyl-2-[4-methoxy-2-(p-anisylthio)benzyl]malonic acid Formula: C23H28O6S MolecularWeight: 432.52982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC1=C(C=C(C=C1)OC)SCC2=CC=C(C=C2)OC)(C(=O)O)C(=O)O

Isomeric SMILES

CC(C)CC(CC1=C(C=C(C=C1)OC)SCC2=CC=C(C=C2)OC)(C(=O)O)C(=O)O

InChI

InChI=1S/C23H28O6S/c1-15(2)12-23(21(24)25,22(26)27)13-17-7-10-19(29-4)11-20(17)30-14-16-5-8-18(28-3)9-6-16/h5-11,15H,12-14H2,1-4H3,(H,24,25)(H,26,27)