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

Systemtic Name: 4-[3-(3-tert-butyl-4-oxidanyl-phenyl)prop-1-ynyl]-2-oxidanyl-benzoic acid Openeye Name: 4-[3-(3-tert-butyl-4-hydroxy-phenyl)prop-1-ynyl]-2-hydroxy-benzoic acid CAS Name: 4-[3-(3-tert-butyl-4-hydroxyphenyl)prop-1-ynyl]-2-hydroxybenzoic acid IUPAC Name: 4-[3-(3-tert-butyl-4-hydroxyphenyl)prop-1-ynyl]-2-hydroxybenzoic acid Traditional Name: 4-[3-(3-tert-butyl-4-hydroxy-phenyl)prop-1-ynyl]-2-hydroxy-benzoic acid Formula: C20H20O4 MolecularWeight: 324.3704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20O4/c1-20(2,3)16-11-13(8-10-17(16)21)5-4-6-14-7-9-15(19(23)24)18(22)12-14/h7-12,21-22H,5H2,1-3H3,(H,23,24)