(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: (1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methyl-(pyridin-3-ylmethyl)azanium Openeye Name: [1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methyl-(3-pyridylmethyl)ammonium CAS Name: [1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methyl-(3-pyridinylmethyl)ammonium IUPAC Name: (1-phenyl-3-pyridin-3-ylpyrazol-4-yl)methyl-(pyridin-3-ylmethyl)azanium Traditional Name: [1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methyl-(3-pyridylmethyl)ammonium Formula: C21H20N5+ MolecularWeight: 342.417

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C[NH2+]CC4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C[NH2+]CC4=CN=CC=C4

InChI

InChI=1S/C21H19N5/c1-2-8-20(9-3-1)26-16-19(15-24-13-17-6-4-10-22-12-17)21(25-26)18-7-5-11-23-14-18/h1-12,14,16,24H,13,15H2/p+1