tert-butyl 1-methyl-4-oxidanylidene-cyclohex-2-ene-1-carboxylate

Systemtic Name: tert-butyl 1-methyl-4-oxidanylidene-cyclohex-2-ene-1-carboxylate Openeye Name: tert-butyl 1-methyl-4-oxo-cyclohex-2-ene-1-carboxylate CAS Name: 1-methyl-4-oxo-1-cyclohex-2-enecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-methyl-4-oxocyclohex-2-ene-1-carboxylate Traditional Name: 4-keto-1-methyl-cyclohex-2-ene-1-carboxylic acid tert-butyl ester Formula: C12H18O3 MolecularWeight: 210.26952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=O)C=C1)C(=O)OC(C)(C)C

Isomeric SMILES

CC1(CCC(=O)C=C1)C(=O)OC(C)(C)C

InChI

InChI=1S/C12H18O3/c1-11(2,3)15-10(14)12(4)7-5-9(13)6-8-12/h5,7H,6,8H2,1-4H3