N-[2-[1-[(4-pyrazol-1-ylphenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]pyridine-3-carboxamide

Systemtic Name: N-[2-[1-[(4-pyrazol-1-ylphenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]pyridine-3-carboxamide Openeye Name: N-[2-[1-[(4-pyrazol-1-ylphenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]pyridine-3-carboxamide CAS Name: N-[2-[1-[[4-(1-pyrazolyl)phenyl]methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]-3-pyridinecarboxamide IUPAC Name: N-[2-[1-[(4-pyrazol-1-ylphenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]pyridine-3-carboxamide Traditional Name: N-[2-[1-(4-pyrazol-1-ylbenzyl)piperidin-1-ium-4-yl]pyrazol-3-yl]nicotinamide Formula: C24H26N7O+ MolecularWeight: 428.50954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)C3=CN=CC=C3)CC4=CC=C(C=C4)N5C=CC=N5

Isomeric SMILES

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)C3=CN=CC=C3)CC4=CC=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C24H25N7O/c32-24(20-3-1-11-25-17-20)28-23-8-13-27-31(23)22-9-15-29(16-10-22)18-19-4-6-21(7-5-19)30-14-2-12-26-30/h1-8,11-14,17,22H,9-10,15-16,18H2,(H,28,32)/p+1