N-(2-morpholin-4-ium-4-ylethyl)-N-[(2-phenylpyrazol-3-yl)methyl]pyridine-3-carboxamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[(2-phenylpyrazol-3-yl)methyl]pyridine-3-carboxamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[(2-phenylpyrazol-3-yl)methyl]pyridine-3-carboxamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-N-[(2-phenyl-3-pyrazolyl)methyl]-3-pyridinecarboxamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[(2-phenylpyrazol-3-yl)methyl]pyridine-3-carboxamide Traditional Name: N-(2-morpholin-4-ium-4-ylethyl)-N-[(2-phenylpyrazol-3-yl)methyl]nicotinamide Formula: C22H26N5O2+ MolecularWeight: 392.47414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN(CC2=CC=NN2C3=CC=CC=C3)C(=O)C4=CN=CC=C4

Isomeric SMILES

C1COCC[NH+]1CCN(CC2=CC=NN2C3=CC=CC=C3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H25N5O2/c28-22(19-5-4-9-23-17-19)26(12-11-25-13-15-29-16-14-25)18-21-8-10-24-27(21)20-6-2-1-3-7-20/h1-10,17H,11-16,18H2/p+1