ethyl 1-[(E)-but-1-enyl]-2-oxidanylidene-cyclohexane-1-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC1(CCCCC1=O)C(=O)OCC

Isomeric SMILES

CC/C=C/C1(CCCCC1=O)C(=O)OCC

InChI

InChI=1S/C13H20O3/c1-3-5-9-13(12(15)16-4-2)10-7-6-8-11(13)14/h5,9H,3-4,6-8,10H2,1-2H3/b9-5+