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

Systemtic Name: 2-[(3,5-dimethyl-4-oxidanyl-phenyl)methyl]-2-(oxan-2-yloxy)propanedioic acid Openeye Name: 2-[(4-hydroxy-3,5-dimethyl-phenyl)methyl]-2-tetrahydropyran-2-yloxy-propanedioic acid CAS Name: 2-[(4-hydroxy-3,5-dimethylphenyl)methyl]-2-(2-oxanyloxy)propanedioic acid IUPAC Name: 2-[(4-hydroxy-3,5-dimethylphenyl)methyl]-2-(oxan-2-yloxy)propanedioic acid Traditional Name: 2-(4-hydroxy-3,5-dimethyl-benzyl)-2-tetrahydropyran-2-yloxy-malonic acid Formula: C17H22O7 MolecularWeight: 338.35238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)CC(C(=O)O)(C(=O)O)OC2CCCCO2

Isomeric SMILES

CC1=CC(=CC(=C1O)C)CC(C(=O)O)(C(=O)O)OC2CCCCO2

InChI

InChI=1S/C17H22O7/c1-10-7-12(8-11(2)14(10)18)9-17(15(19)20,16(21)22)24-13-5-3-4-6-23-13/h7-8,13,18H,3-6,9H2,1-2H3,(H,19,20)(H,21,22)