tert-butyl (1R,2S,6S)-2-ethanoyl-2,6-dimethyl-4-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: tert-butyl (1R,2S,6S)-2-ethanoyl-2,6-dimethyl-4-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: tert-butyl (1R,2S,6S)-2-acetyl-2,6-dimethyl-4-oxo-cyclohexanecarboxylate CAS Name: (1R,2S,6S)-2-acetyl-2,6-dimethyl-4-oxo-1-cyclohexanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (1R,2S,6S)-2-acetyl-2,6-dimethyl-4-oxocyclohexane-1-carboxylate Traditional Name: (1R,2S,6S)-2-acetyl-4-keto-2,6-dimethyl-cyclohexanecarboxylic acid tert-butyl ester Formula: C15H24O4 MolecularWeight: 268.34866

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)CC(C1C(=O)OC(C)(C)C)(C)C(=O)C

Isomeric SMILES

C[C@H]1CC(=O)C[C@]([C@@H]1C(=O)OC(C)(C)C)(C)C(=O)C

InChI

InChI=1S/C15H24O4/c1-9-7-11(17)8-15(6,10(2)16)12(9)13(18)19-14(3,4)5/h9,12H,7-8H2,1-6H3/t9-,12-,15+/m0/s1