5,5-bis(5-tert-butyl-2-methyl-4-oxidanyl-phenyl)pentanoic acid

Systemtic Name: 5,5-bis(5-tert-butyl-2-methyl-4-oxidanyl-phenyl)pentanoic acid Openeye Name: 5,5-bis(5-tert-butyl-4-hydroxy-2-methyl-phenyl)pentanoic acid CAS Name: 5,5-bis(5-tert-butyl-4-hydroxy-2-methylphenyl)pentanoic acid IUPAC Name: 5,5-bis(5-tert-butyl-4-hydroxy-2-methylphenyl)pentanoic acid Traditional Name: 5,5-bis(5-tert-butyl-4-hydroxy-2-methyl-phenyl)valeric acid Formula: C27H38O4 MolecularWeight: 426.58822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(CCCC(=O)O)C2=CC(=C(C=C2C)O)C(C)(C)C)C(C)(C)C)O

Isomeric SMILES

CC1=CC(=C(C=C1C(CCCC(=O)O)C2=CC(=C(C=C2C)O)C(C)(C)C)C(C)(C)C)O

InChI

InChI=1S/C27H38O4/c1-16-12-23(28)21(26(3,4)5)14-19(16)18(10-9-11-25(30)31)20-15-22(27(6,7)8)24(29)13-17(20)2/h12-15,18,28-29H,9-11H2,1-8H3,(H,30,31)