6-morpholin-4-yl-N-[4-(1H-1,2,4-triazol-2-ium-2-yl)phenyl]pyridine-3-carboxamide

Systemtic Name: 6-morpholin-4-yl-N-[4-(1H-1,2,4-triazol-2-ium-2-yl)phenyl]pyridine-3-carboxamide Openeye Name: 6-morpholino-N-[4-(1H-1,2,4-triazol-2-ium-2-yl)phenyl]pyridine-3-carboxamide CAS Name: 6-(4-morpholinyl)-N-[4-(1H-1,2,4-triazol-2-ium-2-yl)phenyl]-3-pyridinecarboxamide IUPAC Name: 6-morpholin-4-yl-N-[4-(1H-1,2,4-triazol-2-ium-2-yl)phenyl]pyridine-3-carboxamide Traditional Name: 6-morpholino-N-[4-(1H-1,2,4-triazol-2-ium-2-yl)phenyl]nicotinamide Formula: C18H19N6O2+ MolecularWeight: 351.38246

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=C(C=C2)C(=O)NC3=CC=C(C=C3)[N+]4=CN=CN4

Isomeric SMILES

C1COCCN1C2=NC=C(C=C2)C(=O)NC3=CC=C(C=C3)[N+]4=CN=CN4

InChI

InChI=1S/C18H18N6O2/c25-18(14-1-6-17(20-11-14)23-7-9-26-10-8-23)22-15-2-4-16(5-3-15)24-13-19-12-21-24/h1-6,11-13H,7-10H2,(H,22,25)/p+1