ethyl (1S,6R)-6-butyl-2-methyl-4-oxidanylidene-cyclohex-2-ene-1-carboxylate

Systemtic Name: ethyl (1S,6R)-6-butyl-2-methyl-4-oxidanylidene-cyclohex-2-ene-1-carboxylate Openeye Name: ethyl (1S,6R)-6-butyl-2-methyl-4-oxo-cyclohex-2-ene-1-carboxylate CAS Name: (1S,6R)-6-butyl-2-methyl-4-oxo-1-cyclohex-2-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,6R)-6-butyl-2-methyl-4-oxocyclohex-2-ene-1-carboxylate Traditional Name: (1S,6R)-6-butyl-4-keto-2-methyl-cyclohex-2-ene-1-carboxylic acid ethyl ester Formula: C14H22O3 MolecularWeight: 238.32268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC(=O)C=C(C1C(=O)OCC)C

Isomeric SMILES

CCCC[C@@H]1CC(=O)C=C([C@H]1C(=O)OCC)C

InChI

InChI=1S/C14H22O3/c1-4-6-7-11-9-12(15)8-10(3)13(11)14(16)17-5-2/h8,11,13H,4-7,9H2,1-3H3/t11-,13-/m1/s1