[3-(2-methylheptan-2-yl)cyclohexa-1,3-dien-1-yl]-phenyl-methanone

Systemtic Name: [3-(2-methylheptan-2-yl)cyclohexa-1,3-dien-1-yl]-phenyl-methanone Openeye Name: [3-(1,1-dimethylhexyl)cyclohexa-1,3-dien-1-yl]-phenyl-methanone CAS Name: [3-(2-methylheptan-2-yl)-1-cyclohexa-1,3-dienyl]-phenylmethanone IUPAC Name: [3-(2-methylheptan-2-yl)cyclohexa-1,3-dien-1-yl]-phenylmethanone Traditional Name: [3-(1,1-dimethylhexyl)cyclohexa-1,3-dien-1-yl]-phenyl-methanone Formula: C21H28O MolecularWeight: 296.44642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)C1=CCCC(=C1)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCC(C)(C)C1=CCCC(=C1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H28O/c1-4-5-9-15-21(2,3)19-14-10-13-18(16-19)20(22)17-11-7-6-8-12-17/h6-8,11-12,14,16H,4-5,9-10,13,15H2,1-3H3