3,5,5-trimethyl-4-[(E)-3-methylpent-3-en-1-ynyl]cyclopent-3-ene-1,2-dione bromide

Systemtic Name: 3,5,5-trimethyl-4-[(E)-3-methylpent-3-en-1-ynyl]cyclopent-3-ene-1,2-dione bromide Openeye Name: 3,5,5-trimethyl-4-[(E)-3-methylpent-3-en-1-ynyl]cyclopent-3-ene-1,2-dione bromide CAS Name: 3,5,5-trimethyl-4-[(E)-3-methylpent-3-en-1-ynyl]cyclopent-3-ene-1,2-dione bromide IUPAC Name: 3,5,5-trimethyl-4-[(E)-3-methylpent-3-en-1-ynyl]cyclopent-3-ene-1,2-dione bromide Traditional Name: 3,5,5-trimethyl-4-[(E)-3-methylpent-3-en-1-ynyl]cyclopent-3-ene-1,2-quinone bromide Formula: C14H16BrO2- MolecularWeight: 296.17964

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C#CC1=C(C(=O)C(=O)C1(C)C)C.[Br-]

Isomeric SMILES

C/C=C(\C)/C#CC1=C(C(=O)C(=O)C1(C)C)C.[Br-]

InChI

InChI=1S/C14H16O2.BrH/c1-6-9(2)7-8-11-10(3)12(15)13(16)14(11,4)5;/h6H,1-5H3;1H/p-1/b9-6+;