propan-2-yl 3,3,6-trimethyl-2-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: propan-2-yl 3,3,6-trimethyl-2-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: isopropyl 3,3,6-trimethyl-2-oxo-cyclohexanecarboxylate CAS Name: 3,3,6-trimethyl-2-oxo-1-cyclohexanecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 3,3,6-trimethyl-2-oxocyclohexane-1-carboxylate Traditional Name: 2-keto-3,3,6-trimethyl-cyclohexanecarboxylic acid isopropyl ester Formula: C13H22O3 MolecularWeight: 226.31198

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(=O)C1C(=O)OC(C)C)(C)C

Isomeric SMILES

CC1CCC(C(=O)C1C(=O)OC(C)C)(C)C

InChI

InChI=1S/C13H22O3/c1-8(2)16-12(15)10-9(3)6-7-13(4,5)11(10)14/h8-10H,6-7H2,1-5H3