methyl (1S,2R)-2-[(1S)-2-oxidanylidenecyclohexyl]cyclohexane-1-carboxylate

Systemtic Name: methyl (1S,2R)-2-[(1S)-2-oxidanylidenecyclohexyl]cyclohexane-1-carboxylate Openeye Name: methyl (1S,2R)-2-[(1S)-2-oxocyclohexyl]cyclohexanecarboxylate CAS Name: (1S,2R)-2-[(1S)-2-oxocyclohexyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1S,2R)-2-[(1S)-2-oxocyclohexyl]cyclohexane-1-carboxylate Traditional Name: (1S,2R)-2-[(1S)-2-ketocyclohexyl]cyclohexanecarboxylic acid methyl ester Formula: C14H22O3 MolecularWeight: 238.32268

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCCC1C2CCCCC2=O

Isomeric SMILES

COC(=O)[C@H]1CCCC[C@@H]1[C@@H]2CCCCC2=O

InChI

InChI=1S/C14H22O3/c1-17-14(16)12-8-3-2-6-10(12)11-7-4-5-9-13(11)15/h10-12H,2-9H2,1H3/t10-,11+,12+/m1/s1