methyl (2S,3S)-2-(4-cyanophenyl)-3-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: methyl (2S,3S)-2-(4-cyanophenyl)-3-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: methyl (2S,3S)-2-(4-cyanophenyl)-3-hydroxy-pyrrolidine-1-carboxylate CAS Name: (2S,3S)-2-(4-cyanophenyl)-3-hydroxy-1-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S)-2-(4-cyanophenyl)-3-hydroxypyrrolidine-1-carboxylate Traditional Name: (2S,3S)-2-(4-cyanophenyl)-3-hydroxy-pyrrolidine-1-carboxylic acid methyl ester Formula: C13H14N2O3 MolecularWeight: 246.26186

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC(C1C2=CC=C(C=C2)C#N)O

Isomeric SMILES

COC(=O)N1CC[C@@H]([C@@H]1C2=CC=C(C=C2)C#N)O

InChI

InChI=1S/C13H14N2O3/c1-18-13(17)15-7-6-11(16)12(15)10-4-2-9(8-14)3-5-10/h2-5,11-12,16H,6-7H2,1H3/t11-,12-/m0/s1