(2R)-N-(3-pyrazol-1-ylphenyl)-1-(pyridin-3-ylmethyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R)-N-(3-pyrazol-1-ylphenyl)-1-(pyridin-3-ylmethyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R)-N-(3-pyrazol-1-ylphenyl)-1-(3-pyridylmethyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2R)-N-[3-(1-pyrazolyl)phenyl]-1-(3-pyridinylmethyl)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R)-N-(3-pyrazol-1-ylphenyl)-1-(pyridin-3-ylmethyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R)-N-(3-pyrazol-1-ylphenyl)-1-(3-pyridylmethyl)pyrrolidin-1-ium-2-carboxamide Formula: C20H22N5O+ MolecularWeight: 348.42158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=CN=CC=C2)C(=O)NC3=CC=CC(=C3)N4C=CC=N4

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC2=CN=CC=C2)C(=O)NC3=CC=CC(=C3)N4C=CC=N4

InChI

InChI=1S/C20H21N5O/c26-20(19-8-3-11-24(19)15-16-5-2-9-21-14-16)23-17-6-1-7-18(13-17)25-12-4-10-22-25/h1-2,4-7,9-10,12-14,19H,3,8,11,15H2,(H,23,26)/p+1/t19-/m1/s1