ethyl 2-cyano-2-[(1R,2S,5S)-2-(2-methoxy-2-oxidanylidene-ethyl)-5-oxidanyl-3-oxidanylidene-cyclopentyl]ethanoate

Systemtic Name: ethyl 2-cyano-2-[(1R,2S,5S)-2-(2-methoxy-2-oxidanylidene-ethyl)-5-oxidanyl-3-oxidanylidene-cyclopentyl]ethanoate Openeye Name: ethyl 2-cyano-2-[(1R,2S,5S)-5-hydroxy-2-(2-methoxy-2-oxo-ethyl)-3-oxo-cyclopentyl]acetate CAS Name: 2-cyano-2-[(1R,2S,5S)-5-hydroxy-2-(2-methoxy-2-oxoethyl)-3-oxocyclopentyl]acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-[(1R,2S,5S)-5-hydroxy-2-(2-methoxy-2-oxoethyl)-3-oxocyclopentyl]acetate Traditional Name: 2-cyano-2-[(1R,2S,5S)-5-hydroxy-3-keto-2-(2-keto-2-methoxy-ethyl)cyclopentyl]acetic acid ethyl ester Formula: C13H17NO6 MolecularWeight: 283.27718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1C(CC(=O)C1CC(=O)OC)O

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO6/c1-3-20-13(18)8(6-14)12-7(4-11(17)19-2)9(15)5-10(12)16/h7-8,10,12,16H,3-5H2,1-2H3/t7-,8?,10+,12-/m1/s1