2-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoyl]decanedioic acid

Systemtic Name: 2-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoyl]decanedioic acid Openeye Name: 2-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoyl]decanedioic acid CAS Name: 2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-oxopropyl]decanedioic acid IUPAC Name: 2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoyl]decanedioic acid Traditional Name: 2-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoyl]sebacic acid Formula: C27H42O6 MolecularWeight: 462.61878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)C(CCCCCCCC(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)C(CCCCCCCC(=O)O)C(=O)O

InChI

InChI=1S/C27H42O6/c1-26(2,3)20-16-18(17-21(24(20)31)27(4,5)6)14-15-22(28)19(25(32)33)12-10-8-7-9-11-13-23(29)30/h16-17,19,31H,7-15H2,1-6H3,(H,29,30)(H,32,33)