6,6-dimethyl-1-(2-methylphenyl)hepta-1,4-diyn-3-ol

Systemtic Name: 6,6-dimethyl-1-(2-methylphenyl)hepta-1,4-diyn-3-ol Openeye Name: 6,6-dimethyl-1-(o-tolyl)hepta-1,4-diyn-3-ol CAS Name: 6,6-dimethyl-1-(2-methylphenyl)-3-hepta-1,4-diynol IUPAC Name: 6,6-dimethyl-1-(2-methylphenyl)hepta-1,4-diyn-3-ol Traditional Name: 6,6-dimethyl-1-(o-tolyl)hepta-1,4-diyn-3-ol Formula: C16H18O MolecularWeight: 226.31352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18O/c1-13-7-5-6-8-14(13)9-10-15(17)11-12-16(2,3)4/h5-8,15,17H,1-4H3