1-(2,6-dimethylphenyl)-6,6-dimethyl-hepta-1,4-diyn-3-one

Systemtic Name: 1-(2,6-dimethylphenyl)-6,6-dimethyl-hepta-1,4-diyn-3-one Openeye Name: 1-(2,6-dimethylphenyl)-6,6-dimethyl-hepta-1,4-diyn-3-one CAS Name: 1-(2,6-dimethylphenyl)-6,6-dimethyl-3-hepta-1,4-diynone IUPAC Name: 1-(2,6-dimethylphenyl)-6,6-dimethylhepta-1,4-diyn-3-one Traditional Name: 1-(2,6-dimethylphenyl)-6,6-dimethyl-hepta-1,4-diyn-3-one Formula: C17H18O MolecularWeight: 238.32422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18O/c1-13-7-6-8-14(2)16(13)10-9-15(18)11-12-17(3,4)5/h6-8H,1-5H3