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

Systemtic Name: 2-[(3,5-dimethyl-4-oxidanyl-phenyl)methyl]-2-oxidanyl-propanedioic acid Openeye Name: 2-hydroxy-2-[(4-hydroxy-3,5-dimethyl-phenyl)methyl]propanedioic acid CAS Name: 2-hydroxy-2-[(4-hydroxy-3,5-dimethylphenyl)methyl]propanedioic acid IUPAC Name: 2-hydroxy-2-[(4-hydroxy-3,5-dimethylphenyl)methyl]propanedioic acid Traditional Name: 2-hydroxy-2-(4-hydroxy-3,5-dimethyl-benzyl)malonic acid Formula: C12H14O6 MolecularWeight: 254.23596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O6/c1-6-3-8(4-7(2)9(6)13)5-12(18,10(14)15)11(16)17/h3-4,13,18H,5H2,1-2H3,(H,14,15)(H,16,17)