2-[(4-tert-butyl-2,6-dimethyl-3-oxidanyl-phenyl)methyl]propanedioic acid

Systemtic Name: 2-[(4-tert-butyl-2,6-dimethyl-3-oxidanyl-phenyl)methyl]propanedioic acid Openeye Name: 2-[(4-tert-butyl-3-hydroxy-2,6-dimethyl-phenyl)methyl]propanedioic acid CAS Name: 2-[(4-tert-butyl-3-hydroxy-2,6-dimethylphenyl)methyl]propanedioic acid IUPAC Name: 2-[(4-tert-butyl-3-hydroxy-2,6-dimethylphenyl)methyl]propanedioic acid Traditional Name: 2-(4-tert-butyl-3-hydroxy-2,6-dimethyl-benzyl)malonic acid Formula: C16H22O5 MolecularWeight: 294.34288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1CC(C(=O)O)C(=O)O)C)O)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C(=C1CC(C(=O)O)C(=O)O)C)O)C(C)(C)C

InChI

InChI=1S/C16H22O5/c1-8-6-12(16(3,4)5)13(17)9(2)10(8)7-11(14(18)19)15(20)21/h6,11,17H,7H2,1-5H3,(H,18,19)(H,20,21)