4-(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)butyl 2,2-dimethylbutanoate

Systemtic Name: 4-(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)butyl 2,2-dimethylbutanoate Openeye Name: 4-(5,5-dimethyl-3-oxo-cyclohexen-1-yl)butyl 2,2-dimethylbutanoate CAS Name: 2,2-dimethylbutanoic acid 4-(5,5-dimethyl-3-oxo-1-cyclohexenyl)butyl ester IUPAC Name: 4-(5,5-dimethyl-3-oxocyclohexen-1-yl)butyl 2,2-dimethylbutanoate Traditional Name: 2,2-dimethylbutyric acid 4-(3-keto-5,5-dimethyl-cyclohexen-1-yl)butyl ester Formula: C18H30O3 MolecularWeight: 294.429

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)OCCCCC1=CC(=O)CC(C1)(C)C

Isomeric SMILES

CCC(C)(C)C(=O)OCCCCC1=CC(=O)CC(C1)(C)C

InChI

InChI=1S/C18H30O3/c1-6-18(4,5)16(20)21-10-8-7-9-14-11-15(19)13-17(2,3)12-14/h11H,6-10,12-13H2,1-5H3