tert-butyl 3-oxidanylidene-5-(2,6,6-trimethylcyclohexen-1-yl)pentanoate

Systemtic Name: tert-butyl 3-oxidanylidene-5-(2,6,6-trimethylcyclohexen-1-yl)pentanoate Openeye Name: tert-butyl 3-oxo-5-(2,6,6-trimethylcyclohexen-1-yl)pentanoate CAS Name: 3-oxo-5-(2,6,6-trimethyl-1-cyclohexenyl)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-oxo-5-(2,6,6-trimethylcyclohexen-1-yl)pentanoate Traditional Name: 3-keto-5-(2,6,6-trimethylcyclohexen-1-yl)valeric acid tert-butyl ester Formula: C18H30O3 MolecularWeight: 294.429

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)CCC(=O)CC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C(CCC1)(C)C)CCC(=O)CC(=O)OC(C)(C)C

InChI

InChI=1S/C18H30O3/c1-13-8-7-11-18(5,6)15(13)10-9-14(19)12-16(20)21-17(2,3)4/h7-12H2,1-6H3