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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=CC=CC=N2)C(=O)NC3=CC=CC(=C3)N4C=CC=N4

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC2=CC=CC=N2)C(=O)NC3=CC=CC(=C3)N4C=CC=N4

InChI

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