2,4,4-trimethyl-3-[(1E,3E)-3-methylpenta-1,3-dienyl]cyclopent-2-en-1-one bromide

Systemtic Name: 2,4,4-trimethyl-3-[(1E,3E)-3-methylpenta-1,3-dienyl]cyclopent-2-en-1-one bromide Openeye Name: 2,4,4-trimethyl-3-[(1E,3E)-3-methylpenta-1,3-dienyl]cyclopent-2-en-1-one bromide CAS Name: 2,4,4-trimethyl-3-[(1E,3E)-3-methylpenta-1,3-dienyl]-1-cyclopent-2-enone bromide IUPAC Name: 2,4,4-trimethyl-3-[(1E,3E)-3-methylpenta-1,3-dienyl]cyclopent-2-en-1-one bromide Traditional Name: 2,4,4-trimethyl-3-[(1E,3E)-3-methylpenta-1,3-dienyl]cyclopent-2-en-1-one bromide Formula: C14H20BrO- MolecularWeight: 284.212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20O.BrH/c1-6-10(2)7-8-12-11(3)13(15)9-14(12,4)5;/h6-8H,9H2,1-5H3;1H/p-1/b8-7+,10-6+;