methyl 1-methyl-2,5-bis(oxidanylidene)cyclohexane-1-carboxylate

Systemtic Name: methyl 1-methyl-2,5-bis(oxidanylidene)cyclohexane-1-carboxylate Openeye Name: methyl 1-methyl-2,5-dioxo-cyclohexanecarboxylate CAS Name: 1-methyl-2,5-dioxo-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-methyl-2,5-dioxocyclohexane-1-carboxylate Traditional Name: 2,5-diketo-1-methyl-cyclohexanecarboxylic acid methyl ester Formula: C9H12O4 MolecularWeight: 184.18918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)CCC1=O)C(=O)OC

Isomeric SMILES

CC1(CC(=O)CCC1=O)C(=O)OC

InChI

InChI=1S/C9H12O4/c1-9(8(12)13-2)5-6(10)3-4-7(9)11/h3-5H2,1-2H3