6,6-bis(3,5-ditert-butyl-4-oxidanyl-phenyl)heptanoic acid

Systemtic Name: 6,6-bis(3,5-ditert-butyl-4-oxidanyl-phenyl)heptanoic acid Openeye Name: 6,6-bis(3,5-ditert-butyl-4-hydroxy-phenyl)heptanoic acid CAS Name: 6,6-bis(3,5-ditert-butyl-4-hydroxyphenyl)heptanoic acid IUPAC Name: 6,6-bis(3,5-ditert-butyl-4-hydroxyphenyl)heptanoic acid Traditional Name: 6,6-bis(3,5-ditert-butyl-4-hydroxy-phenyl)enanthic acid Formula: C35H54O4 MolecularWeight: 538.80086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(C)(CCCCC(=O)O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(C)(CCCCC(=O)O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C35H54O4/c1-31(2,3)24-18-22(19-25(29(24)38)32(4,5)6)35(13,17-15-14-16-28(36)37)23-20-26(33(7,8)9)30(39)27(21-23)34(10,11)12/h18-21,38-39H,14-17H2,1-13H3,(H,36,37)