2-oxidanyl-4-[3-oxidanyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)but-1-ynyl]benzoic acid

Systemtic Name: 2-oxidanyl-4-[3-oxidanyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)but-1-ynyl]benzoic acid Openeye Name: 2-hydroxy-4-[3-hydroxy-3-(1,1,4,4-tetramethyltetralin-6-yl)but-1-ynyl]benzoic acid CAS Name: 2-hydroxy-4-[3-hydroxy-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)but-1-ynyl]benzoic acid IUPAC Name: 2-hydroxy-4-[3-hydroxy-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)but-1-ynyl]benzoic acid Traditional Name: 2-hydroxy-4-[3-hydroxy-3-(1,1,4,4-tetramethyltetralin-6-yl)but-1-ynyl]benzoic acid Formula: C25H28O4 MolecularWeight: 392.48742

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=CC(=C2)C(C)(C#CC3=CC(=C(C=C3)C(=O)O)O)O)(C)C)C

Isomeric SMILES

CC1(CCC(C2=C1C=CC(=C2)C(C)(C#CC3=CC(=C(C=C3)C(=O)O)O)O)(C)C)C

InChI

InChI=1S/C25H28O4/c1-23(2)12-13-24(3,4)20-15-17(7-9-19(20)23)25(5,29)11-10-16-6-8-18(22(27)28)21(26)14-16/h6-9,14-15,26,29H,12-13H2,1-5H3,(H,27,28)