ethyl (1R,3R)-3-but-3-enyl-2-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: ethyl (1R,3R)-3-but-3-enyl-2-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: ethyl (1R,3R)-3-but-3-enyl-2-oxo-cyclohexanecarboxylate CAS Name: (1R,3R)-3-but-3-enyl-2-oxo-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl (1R,3R)-3-but-3-enyl-2-oxocyclohexane-1-carboxylate Traditional Name: (1R,3R)-3-but-3-enyl-2-keto-cyclohexanecarboxylic acid ethyl ester Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCC(C1=O)CCC=C

Isomeric SMILES

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

InChI

InChI=1S/C13H20O3/c1-3-5-7-10-8-6-9-11(12(10)14)13(15)16-4-2/h3,10-11H,1,4-9H2,2H3/t10-,11+/m0/s1