2-[(4-methoxyphenyl)sulfanylmethyl]-2-(oxan-2-yloxy)propanedioic acid

Systemtic Name: 2-[(4-methoxyphenyl)sulfanylmethyl]-2-(oxan-2-yloxy)propanedioic acid Openeye Name: 2-[(4-methoxyphenyl)sulfanylmethyl]-2-tetrahydropyran-2-yloxy-propanedioic acid CAS Name: 2-[[(4-methoxyphenyl)thio]methyl]-2-(2-oxanyloxy)propanedioic acid IUPAC Name: 2-[(4-methoxyphenyl)sulfanylmethyl]-2-(oxan-2-yloxy)propanedioic acid Traditional Name: 2-[[(4-methoxyphenyl)thio]methyl]-2-tetrahydropyran-2-yloxy-malonic acid Formula: C16H20O7S MolecularWeight: 356.3908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCC(C(=O)O)(C(=O)O)OC2CCCCO2

Isomeric SMILES

COC1=CC=C(C=C1)SCC(C(=O)O)(C(=O)O)OC2CCCCO2

InChI

InChI=1S/C16H20O7S/c1-21-11-5-7-12(8-6-11)24-10-16(14(17)18,15(19)20)23-13-4-2-3-9-22-13/h5-8,13H,2-4,9-10H2,1H3,(H,17,18)(H,19,20)