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

Systemtic Name: methyl 2-oxidanyl-4-[3-oxidanyl-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)but-1-ynyl]benzoate Openeye Name: methyl 2-hydroxy-4-[3-hydroxy-3-(1,1,4,4-tetramethyltetralin-6-yl)but-1-ynyl]benzoate CAS Name: 2-hydroxy-4-[3-hydroxy-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)but-1-ynyl]benzoic acid methyl ester IUPAC Name: methyl 2-hydroxy-4-[3-hydroxy-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)but-1-ynyl]benzoate Traditional Name: 2-hydroxy-4-[3-hydroxy-3-(1,1,4,4-tetramethyltetralin-6-yl)but-1-ynyl]benzoic acid methyl ester Formula: C26H30O4 MolecularWeight: 406.514

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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)OC)O)O)(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C26H30O4/c1-24(2)13-14-25(3,4)21-16-18(8-10-20(21)24)26(5,29)12-11-17-7-9-19(22(27)15-17)23(28)30-6/h7-10,15-16,27,29H,13-14H2,1-6H3