(2R)-N-(4-pyrazol-1-ylphenyl)-1-(3-pyrazol-1-ylpropyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R)-N-(4-pyrazol-1-ylphenyl)-1-(3-pyrazol-1-ylpropyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R)-N-(4-pyrazol-1-ylphenyl)-1-(3-pyrazol-1-ylpropyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2R)-N-[4-(1-pyrazolyl)phenyl]-1-[3-(1-pyrazolyl)propyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R)-N-(4-pyrazol-1-ylphenyl)-1-(3-pyrazol-1-ylpropyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R)-N-(4-pyrazol-1-ylphenyl)-1-(3-pyrazol-1-ylpropyl)pyrrolidin-1-ium-2-carboxamide Formula: C20H25N6O+ MolecularWeight: 365.4521

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CCCN2C=CC=N2)C(=O)NC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1C[C@@H]([NH+](C1)CCCN2C=CC=N2)C(=O)NC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C20H24N6O/c27-20(23-17-6-8-18(9-7-17)26-16-3-11-22-26)19-5-1-12-24(19)13-4-15-25-14-2-10-21-25/h2-3,6-11,14,16,19H,1,4-5,12-13,15H2,(H,23,27)/p+1/t19-/m1/s1