4-(2-methylhex-5-en-3-yn-2-yl)cyclohexa-2,4-dien-1-one

Systemtic Name: 4-(2-methylhex-5-en-3-yn-2-yl)cyclohexa-2,4-dien-1-one Openeye Name: 4-(1,1-dimethylpent-4-en-2-ynyl)cyclohexa-2,4-dien-1-one CAS Name: 4-(2-methylhex-5-en-3-yn-2-yl)-1-cyclohexa-2,4-dienone IUPAC Name: 4-(2-methylhex-5-en-3-yn-2-yl)cyclohexa-2,4-dien-1-one Traditional Name: 4-(1,1-dimethylpent-4-en-2-ynyl)cyclohexa-2,4-dien-1-one Formula: C13H14O MolecularWeight: 186.24966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14O/c1-4-5-10-13(2,3)11-6-8-12(14)9-7-11/h4,6-8H,1,9H2,2-3H3