dimethyl (1S,2R,4R,5S)-4-cyano-5-oxidanyl-cyclohexane-1,2-dicarboxylate

Systemtic Name: dimethyl (1S,2R,4R,5S)-4-cyano-5-oxidanyl-cyclohexane-1,2-dicarboxylate Openeye Name: dimethyl (1S,2R,4R,5S)-4-cyano-5-hydroxy-cyclohexane-1,2-dicarboxylate CAS Name: (1S,2R,4R,5S)-4-cyano-5-hydroxycyclohexane-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (1S,2R,4R,5S)-4-cyano-5-hydroxycyclohexane-1,2-dicarboxylate Traditional Name: (1S,2R,4R,5S)-4-cyano-5-hydroxy-cyclohexane-1,2-dicarboxylic acid dimethyl ester Formula: C11H15NO5 MolecularWeight: 241.2405

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(C(CC1C(=O)OC)O)C#N

Isomeric SMILES

COC(=O)[C@@H]1C[C@@H]([C@H](C[C@@H]1C(=O)OC)O)C#N

InChI

InChI=1S/C11H15NO5/c1-16-10(14)7-3-6(5-12)9(13)4-8(7)11(15)17-2/h6-9,13H,3-4H2,1-2H3/t6-,7-,8+,9+/m1/s1