2-methyl-4-[2,3,4,5,6-pentakis(3-methyl-3-oxidanyl-but-1-ynyl)phenyl]but-3-yn-2-ol

Systemtic Name: 2-methyl-4-[2,3,4,5,6-pentakis(3-methyl-3-oxidanyl-but-1-ynyl)phenyl]but-3-yn-2-ol Openeye Name: 2-methyl-4-[2,3,4,5,6-pentakis(3-hydroxy-3-methyl-but-1-ynyl)phenyl]but-3-yn-2-ol CAS Name: 2-methyl-4-[2,3,4,5,6-pentakis(3-hydroxy-3-methylbut-1-ynyl)phenyl]-3-butyn-2-ol IUPAC Name: 2-methyl-4-[2,3,4,5,6-pentakis(3-hydroxy-3-methylbut-1-ynyl)phenyl]but-3-yn-2-ol Traditional Name: 2-methyl-4-[2,3,4,5,6-pentakis(3-hydroxy-3-methyl-but-1-ynyl)phenyl]but-3-yn-2-ol Formula: C36H42O6 MolecularWeight: 570.71508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=C(C(=C(C(=C1C#CC(C)(C)O)C#CC(C)(C)O)C#CC(C)(C)O)C#CC(C)(C)O)C#CC(C)(C)O)O

Isomeric SMILES

CC(C)(C#CC1=C(C(=C(C(=C1C#CC(C)(C)O)C#CC(C)(C)O)C#CC(C)(C)O)C#CC(C)(C)O)C#CC(C)(C)O)O

InChI

InChI=1S/C36H42O6/c1-31(2,37)19-13-25-26(14-20-32(3,4)38)28(16-22-34(7,8)40)30(18-24-36(11,12)42)29(17-23-35(9,10)41)27(25)15-21-33(5,6)39/h37-42H,1-12H3