2-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]-2-(oxan-2-yloxy)propanedioic acid

Systemtic Name: 2-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]-2-(oxan-2-yloxy)propanedioic acid Openeye Name: 2-[(4-hydroxy-3,5-dimethoxy-phenyl)methyl]-2-tetrahydropyran-2-yloxy-propanedioic acid CAS Name: 2-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-2-(2-oxanyloxy)propanedioic acid IUPAC Name: 2-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-2-(oxan-2-yloxy)propanedioic acid Traditional Name: 2-(4-hydroxy-3,5-dimethoxy-benzyl)-2-tetrahydropyran-2-yloxy-malonic acid Formula: C17H22O9 MolecularWeight: 370.35118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)CC(C(=O)O)(C(=O)O)OC2CCCCO2

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)CC(C(=O)O)(C(=O)O)OC2CCCCO2

InChI

InChI=1S/C17H22O9/c1-23-11-7-10(8-12(24-2)14(11)18)9-17(15(19)20,16(21)22)26-13-5-3-4-6-25-13/h7-8,13,18H,3-6,9H2,1-2H3,(H,19,20)(H,21,22)