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

Systemtic Name: 2-oxidanyl-4-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)but-1-ynyl]benzoic acid Openeye Name: 2-hydroxy-4-[3-(1,1,4,4-tetramethyltetralin-6-yl)but-1-ynyl]benzoic acid CAS Name: 2-hydroxy-4-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)but-1-ynyl]benzoic acid IUPAC Name: 2-hydroxy-4-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)but-1-ynyl]benzoic acid Traditional Name: 2-hydroxy-4-[3-(1,1,4,4-tetramethyltetralin-6-yl)but-1-ynyl]benzoic acid Formula: C25H28O3 MolecularWeight: 376.48802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC(=C(C=C1)C(=O)O)O)C2=CC3=C(C=C2)C(CCC3(C)C)(C)C

Isomeric SMILES

CC(C#CC1=CC(=C(C=C1)C(=O)O)O)C2=CC3=C(C=C2)C(CCC3(C)C)(C)C

InChI

InChI=1S/C25H28O3/c1-16(6-7-17-8-10-19(23(27)28)22(26)14-17)18-9-11-20-21(15-18)25(4,5)13-12-24(20,2)3/h8-11,14-16,26H,12-13H2,1-5H3,(H,27,28)