methyl 3,3,5,5-tetramethyl-4-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: methyl 3,3,5,5-tetramethyl-4-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: methyl 3,3,5,5-tetramethyl-4-oxo-cyclohexanecarboxylate CAS Name: 3,3,5,5-tetramethyl-4-oxo-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 3,3,5,5-tetramethyl-4-oxocyclohexane-1-carboxylate Traditional Name: 4-keto-3,3,5,5-tetramethyl-cyclohexanecarboxylic acid methyl ester Formula: C12H20O3 MolecularWeight: 212.2854

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1=O)(C)C)C(=O)OC)C

Isomeric SMILES

CC1(CC(CC(C1=O)(C)C)C(=O)OC)C

InChI

InChI=1S/C12H20O3/c1-11(2)6-8(9(13)15-5)7-12(3,4)10(11)14/h8H,6-7H2,1-5H3