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

Systemtic Name: 2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]-2-(oxan-2-yloxy)propanedioic acid Openeye Name: 2-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]-2-tetrahydropyran-2-yloxy-propanedioic acid CAS Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-(2-oxanyloxy)propanedioic acid IUPAC Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-2-(oxan-2-yloxy)propanedioic acid Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-benzyl)-2-tetrahydropyran-2-yloxy-malonic acid Formula: C23H34O7 MolecularWeight: 422.51186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(C(=O)O)(C(=O)O)OC2CCCCO2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(C(=O)O)(C(=O)O)OC2CCCCO2

InChI

InChI=1S/C23H34O7/c1-21(2,3)15-11-14(12-16(18(15)24)22(4,5)6)13-23(19(25)26,20(27)28)30-17-9-7-8-10-29-17/h11-12,17,24H,7-10,13H2,1-6H3,(H,25,26)(H,27,28)