ethyl (1R,6R)-1,3,3,6-tetramethyl-2-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: ethyl (1R,6R)-1,3,3,6-tetramethyl-2-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: ethyl (1R,6R)-1,3,3,6-tetramethyl-2-oxo-cyclohexanecarboxylate CAS Name: (1R,6R)-1,3,3,6-tetramethyl-2-oxo-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl (1R,6R)-1,3,3,6-tetramethyl-2-oxocyclohexane-1-carboxylate Traditional Name: (1R,6R)-2-keto-1,3,3,6-tetramethyl-cyclohexanecarboxylic acid ethyl ester Formula: C13H22O3 MolecularWeight: 226.31198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(CCC(C1=O)(C)C)C)C

Isomeric SMILES

CCOC(=O)[C@@]1([C@@H](CCC(C1=O)(C)C)C)C

InChI

InChI=1S/C13H22O3/c1-6-16-11(15)13(5)9(2)7-8-12(3,4)10(13)14/h9H,6-8H2,1-5H3/t9-,13-/m1/s1