(2S,4R)-4-oxidanyl-N-(2-pyridin-2-ylethyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S,4R)-4-oxidanyl-N-(2-pyridin-2-ylethyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S,4R)-4-hydroxy-N-[2-(2-pyridyl)ethyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2S,4R)-4-hydroxy-N-[2-(2-pyridinyl)ethyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S,4R)-4-hydroxy-N-(2-pyridin-2-ylethyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S,4R)-4-hydroxy-N-[2-(2-pyridyl)ethyl]pyrrolidin-1-ium-2-carboxamide Formula: C12H18N3O2+ MolecularWeight: 236.29022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C[NH2+]C1C(=O)NCCC2=CC=CC=N2)O

Isomeric SMILES

C1[C@H](C[NH2+][C@@H]1C(=O)NCCC2=CC=CC=N2)O

InChI

InChI=1S/C12H17N3O2/c16-10-7-11(15-8-10)12(17)14-6-4-9-3-1-2-5-13-9/h1-3,5,10-11,15-16H,4,6-8H2,(H,14,17)/p+1/t10-,11+/m1/s1