methyl 2-ethyl-4,6-bis(oxidanylidene)-3-propyl-cyclohexane-1-carboxylate

Systemtic Name: methyl 2-ethyl-4,6-bis(oxidanylidene)-3-propyl-cyclohexane-1-carboxylate Openeye Name: methyl 2-ethyl-4,6-dioxo-3-propyl-cyclohexanecarboxylate CAS Name: 2-ethyl-4,6-dioxo-3-propyl-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-4,6-dioxo-3-propylcyclohexane-1-carboxylate Traditional Name: 2-ethyl-4,6-diketo-3-propyl-cyclohexanecarboxylic acid methyl ester Formula: C13H20O4 MolecularWeight: 240.2955

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C(C(=O)CC1=O)C(=O)OC)CC

Isomeric SMILES

CCCC1C(C(C(=O)CC1=O)C(=O)OC)CC

InChI

InChI=1S/C13H20O4/c1-4-6-9-8(5-2)12(13(16)17-3)11(15)7-10(9)14/h8-9,12H,4-7H2,1-3H3