methyl 3-[(1S,2S)-2-methanoyl-1,2-dimethyl-6-oxidanylidene-cyclohexyl]propanoate

Systemtic Name: methyl 3-[(1S,2S)-2-methanoyl-1,2-dimethyl-6-oxidanylidene-cyclohexyl]propanoate Openeye Name: methyl 3-[(1S,2S)-2-formyl-1,2-dimethyl-6-oxo-cyclohexyl]propanoate CAS Name: 3-[(1S,2S)-2-formyl-1,2-dimethyl-6-oxocyclohexyl]propanoic acid methyl ester IUPAC Name: methyl 3-[(1S,2S)-2-formyl-1,2-dimethyl-6-oxocyclohexyl]propanoate Traditional Name: 3-[(1S,2S)-2-formyl-6-keto-1,2-dimethyl-cyclohexyl]propionic acid methyl ester Formula: C13H20O4 MolecularWeight: 240.2955

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@]1(CCCC(=O)[C@@]1(C)CCC(=O)OC)C=O

InChI

InChI=1S/C13H20O4/c1-12(9-14)7-4-5-10(15)13(12,2)8-6-11(16)17-3/h9H,4-8H2,1-3H3/t12-,13-/m1/s1