methyl 3-oxidanylidene-1-(3-oxidanylpent-1-en-3-yl)cyclohexane-1-carboxylate

Systemtic Name: methyl 3-oxidanylidene-1-(3-oxidanylpent-1-en-3-yl)cyclohexane-1-carboxylate Openeye Name: methyl 1-(1-ethyl-1-hydroxy-allyl)-3-oxo-cyclohexanecarboxylate CAS Name: 1-(3-hydroxypent-1-en-3-yl)-3-oxo-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-hydroxypent-1-en-3-yl)-3-oxocyclohexane-1-carboxylate Traditional Name: 1-(1-ethyl-1-hydroxy-allyl)-3-keto-cyclohexanecarboxylic acid methyl ester Formula: C13H20O4 MolecularWeight: 240.2955

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C=C)(C1(CCCC(=O)C1)C(=O)OC)O

Isomeric SMILES

CCC(C=C)(C1(CCCC(=O)C1)C(=O)OC)O

InChI

InChI=1S/C13H20O4/c1-4-13(16,5-2)12(11(15)17-3)8-6-7-10(14)9-12/h4,16H,1,5-9H2,2-3H3