1-(4-fluorophenyl)-6,6-dimethyl-hepta-1,4-diyn-3-one

Systemtic Name: 1-(4-fluorophenyl)-6,6-dimethyl-hepta-1,4-diyn-3-one Openeye Name: 1-(4-fluorophenyl)-6,6-dimethyl-hepta-1,4-diyn-3-one CAS Name: 1-(4-fluorophenyl)-6,6-dimethyl-3-hepta-1,4-diynone IUPAC Name: 1-(4-fluorophenyl)-6,6-dimethylhepta-1,4-diyn-3-one Traditional Name: 1-(4-fluorophenyl)-6,6-dimethyl-hepta-1,4-diyn-3-one Formula: C15H13FO MolecularWeight: 228.261523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C#CC(=O)C#CC1=CC=C(C=C1)F

Isomeric SMILES

CC(C)(C)C#CC(=O)C#CC1=CC=C(C=C1)F

InChI

InChI=1S/C15H13FO/c1-15(2,3)11-10-14(17)9-6-12-4-7-13(16)8-5-12/h4-5,7-8H,1-3H3