2-butanoyl-5-(2,6,6-trimethylcyclohexen-1-yl)cyclohexane-1,3-dione

Systemtic Name: 2-butanoyl-5-(2,6,6-trimethylcyclohexen-1-yl)cyclohexane-1,3-dione Openeye Name: 2-butanoyl-5-(2,6,6-trimethylcyclohexen-1-yl)cyclohexane-1,3-dione CAS Name: 2-(1-oxobutyl)-5-(2,6,6-trimethyl-1-cyclohexenyl)cyclohexane-1,3-dione IUPAC Name: 2-butanoyl-5-(2,6,6-trimethylcyclohexen-1-yl)cyclohexane-1,3-dione Traditional Name: 2-butyryl-5-(2,6,6-trimethylcyclohexen-1-yl)cyclohexane-1,3-quinone Formula: C19H28O3 MolecularWeight: 304.42382

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1C(=O)CC(CC1=O)C2=C(CCCC2(C)C)C

Isomeric SMILES

CCCC(=O)C1C(=O)CC(CC1=O)C2=C(CCCC2(C)C)C

InChI

InChI=1S/C19H28O3/c1-5-7-14(20)17-15(21)10-13(11-16(17)22)18-12(2)8-6-9-19(18,3)4/h13,17H,5-11H2,1-4H3