ethyl 2-but-3-ynyl-6-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: ethyl 2-but-3-ynyl-6-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: ethyl 2-but-3-ynyl-6-oxo-cyclohexanecarboxylate CAS Name: 2-but-3-ynyl-6-oxo-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 2-but-3-ynyl-6-oxocyclohexane-1-carboxylate Traditional Name: 2-but-3-ynyl-6-keto-cyclohexanecarboxylic acid ethyl ester Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CCCC1=O)CCC#C

Isomeric SMILES

CCOC(=O)C1C(CCCC1=O)CCC#C

InChI

InChI=1S/C13H18O3/c1-3-5-7-10-8-6-9-11(14)12(10)13(15)16-4-2/h1,10,12H,4-9H2,2H3