4-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-1-ynyl]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-1-ynyl]-2-oxidanyl-benzoic acid Openeye Name: 4-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)prop-1-ynyl]-2-hydroxy-benzoic acid CAS Name: 4-[3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-1-ynyl]-2-hydroxybenzoic acid IUPAC Name: 4-[3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-1-ynyl]-2-hydroxybenzoic acid Traditional Name: 4-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)prop-1-ynyl]-2-hydroxy-benzoic acid Formula: C24H28O4 MolecularWeight: 380.47672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC#CC2=CC(=C(C=C2)C(=O)O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC#CC2=CC(=C(C=C2)C(=O)O)O

InChI

InChI=1S/C24H28O4/c1-23(2,3)18-12-16(13-19(21(18)26)24(4,5)6)9-7-8-15-10-11-17(22(27)28)20(25)14-15/h10-14,25-26H,9H2,1-6H3,(H,27,28)