methyl 2-methanoyl-1,3-dimethyl-4-(3-oxidanylidenebutanoyloxy)cyclohex-2-ene-1-carboxylate

Systemtic Name: methyl 2-methanoyl-1,3-dimethyl-4-(3-oxidanylidenebutanoyloxy)cyclohex-2-ene-1-carboxylate Openeye Name: methyl 2-formyl-1,3-dimethyl-4-(3-oxobutanoyloxy)cyclohex-2-ene-1-carboxylate CAS Name: 4-(1,3-dioxobutoxy)-2-formyl-1,3-dimethyl-1-cyclohex-2-enecarboxylic acid methyl ester IUPAC Name: methyl 2-formyl-1,3-dimethyl-4-(3-oxobutanoyloxy)cyclohex-2-ene-1-carboxylate Traditional Name: 4-acetoacetyloxy-2-formyl-1,3-dimethyl-cyclohex-2-ene-1-carboxylic acid methyl ester Formula: C15H20O6 MolecularWeight: 296.3157

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1OC(=O)CC(=O)C)(C)C(=O)OC)C=O

Isomeric SMILES

CC1=C(C(CCC1OC(=O)CC(=O)C)(C)C(=O)OC)C=O

InChI

InChI=1S/C15H20O6/c1-9(17)7-13(18)21-12-5-6-15(3,14(19)20-4)11(8-16)10(12)2/h8,12H,5-7H2,1-4H3