4-cyclohexa-1,5-dien-1-yl-3,3-dimethyl-butan-2-one

Systemtic Name: 4-cyclohexa-1,5-dien-1-yl-3,3-dimethyl-butan-2-one Openeye Name: 4-cyclohexa-1,5-dien-1-yl-3,3-dimethyl-butan-2-one CAS Name: 4-(1-cyclohexa-1,5-dienyl)-3,3-dimethyl-2-butanone IUPAC Name: 4-cyclohexa-1,5-dien-1-yl-3,3-dimethylbutan-2-one Traditional Name: 4-cyclohexa-1,5-dien-1-yl-3,3-dimethyl-butan-2-one Formula: C12H18O MolecularWeight: 178.27072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18O/c1-10(13)12(2,3)9-11-7-5-4-6-8-11/h5,7-8H,4,6,9H2,1-3H3