2-methyl-4-[7-(3-methyl-3-oxidanyl-but-1-ynyl)pyren-2-yl]but-3-yn-2-ol

Systemtic Name: 2-methyl-4-[7-(3-methyl-3-oxidanyl-but-1-ynyl)pyren-2-yl]but-3-yn-2-ol Openeye Name: 4-[7-(3-hydroxy-3-methyl-but-1-ynyl)pyren-2-yl]-2-methyl-but-3-yn-2-ol CAS Name: 4-[7-(3-hydroxy-3-methylbut-1-ynyl)-2-pyrenyl]-2-methyl-3-butyn-2-ol IUPAC Name: 4-[7-(3-hydroxy-3-methylbut-1-ynyl)pyren-2-yl]-2-methylbut-3-yn-2-ol Traditional Name: 4-[7-(3-hydroxy-3-methyl-but-1-ynyl)pyren-2-yl]-2-methyl-but-3-yn-2-ol Formula: C26H22O2 MolecularWeight: 366.45168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC2=C3C(=C1)C=CC4=CC(=CC(=C43)C=C2)C#CC(C)(C)O)O

Isomeric SMILES

CC(C)(C#CC1=CC2=C3C(=C1)C=CC4=CC(=CC(=C43)C=C2)C#CC(C)(C)O)O

InChI

InChI=1S/C26H22O2/c1-25(2,27)11-9-17-13-19-5-7-21-15-18(10-12-26(3,4)28)16-22-8-6-20(14-17)23(19)24(21)22/h5-8,13-16,27-28H,1-4H3