ethyl 2-oxidanylidene-1-(3-oxidanylpent-4-ynyl)cyclohexane-1-carboxylate

Systemtic Name: ethyl 2-oxidanylidene-1-(3-oxidanylpent-4-ynyl)cyclohexane-1-carboxylate Openeye Name: ethyl 1-(3-hydroxypent-4-ynyl)-2-oxo-cyclohexanecarboxylate CAS Name: 1-(3-hydroxypent-4-ynyl)-2-oxo-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-hydroxypent-4-ynyl)-2-oxocyclohexane-1-carboxylate Traditional Name: 1-(3-hydroxypent-4-ynyl)-2-keto-cyclohexanecarboxylic acid ethyl ester Formula: C14H20O4 MolecularWeight: 252.3062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCCC1=O)CCC(C#C)O

Isomeric SMILES

CCOC(=O)C1(CCCCC1=O)CCC(C#C)O

InChI

InChI=1S/C14H20O4/c1-3-11(15)8-10-14(13(17)18-4-2)9-6-5-7-12(14)16/h1,11,15H,4-10H2,2H3