methyl 4-(1-oxidanylbutylidene)-3,5-bis(oxidanylidene)cyclohexane-1-carboxylate

Systemtic Name: methyl 4-(1-oxidanylbutylidene)-3,5-bis(oxidanylidene)cyclohexane-1-carboxylate Openeye Name: methyl 4-(1-hydroxybutylidene)-3,5-dioxo-cyclohexanecarboxylate CAS Name: 4-(1-hydroxybutylidene)-3,5-dioxo-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-(1-hydroxybutylidene)-3,5-dioxocyclohexane-1-carboxylate Traditional Name: 4-(1-hydroxybutylidene)-3,5-diketo-cyclohexanecarboxylic acid methyl ester Formula: C12H16O5 MolecularWeight: 240.25244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C1C(=O)CC(CC1=O)C(=O)OC)O

Isomeric SMILES

CCCC(=C1C(=O)CC(CC1=O)C(=O)OC)O

InChI

InChI=1S/C12H16O5/c1-3-4-8(13)11-9(14)5-7(6-10(11)15)12(16)17-2/h7,13H,3-6H2,1-2H3