4-morpholin-4-yl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide

Systemtic Name: 4-morpholin-4-yl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide Openeye Name: 4-morpholino-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide CAS Name: 4-(4-morpholinyl)-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-2-pyridinecarboxamide IUPAC Name: 4-morpholin-4-yl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide Traditional Name: 4-morpholino-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]picolinamide Formula: C22H29N4O2+ MolecularWeight: 381.49126

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=CC=C2CNC(=O)C3=NC=CC(=C3)N4CCOCC4

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=CC=C2CNC(=O)C3=NC=CC(=C3)N4CCOCC4

InChI

InChI=1S/C22H28N4O2/c27-22(21-15-20(7-8-23-21)26-11-13-28-14-12-26)24-16-18-5-1-2-6-19(18)17-25-9-3-4-10-25/h1-2,5-8,15H,3-4,9-14,16-17H2,(H,24,27)/p+1