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

Systemtic Name: methyl (2S,3S)-2-(4-cyanophenyl)-3-oxidanyl-piperidine-1-carboxylate Openeye Name: methyl (2S,3S)-2-(4-cyanophenyl)-3-hydroxy-piperidine-1-carboxylate CAS Name: (2S,3S)-2-(4-cyanophenyl)-3-hydroxy-1-piperidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S)-2-(4-cyanophenyl)-3-hydroxypiperidine-1-carboxylate Traditional Name: (2S,3S)-2-(4-cyanophenyl)-3-hydroxy-piperidine-1-carboxylic acid methyl ester Formula: C14H16N2O3 MolecularWeight: 260.28844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCCC(C1C2=CC=C(C=C2)C#N)O

Isomeric SMILES

COC(=O)N1CCC[C@@H]([C@@H]1C2=CC=C(C=C2)C#N)O

InChI

InChI=1S/C14H16N2O3/c1-19-14(18)16-8-2-3-12(17)13(16)11-6-4-10(9-15)5-7-11/h4-7,12-13,17H,2-3,8H2,1H3/t12-,13-/m0/s1