2-(furan-2-yl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]quinoline-4-carboxamide

Systemtic Name: 2-(furan-2-yl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]quinoline-4-carboxamide Openeye Name: 2-(2-furyl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]quinoline-4-carboxamide CAS Name: 2-(2-furanyl)-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-4-quinolinecarboxamide IUPAC Name: 2-(furan-2-yl)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]quinoline-4-carboxamide Traditional Name: 2-(2-furyl)-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]cinchoninamide Formula: C26H26N3O3+ MolecularWeight: 428.50294

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CO5

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CO5

InChI

InChI=1S/C26H25N3O3/c30-26(27-17-19-6-1-2-7-20(19)18-29-11-14-31-15-12-29)22-16-24(25-10-5-13-32-25)28-23-9-4-3-8-21(22)23/h1-10,13,16H,11-12,14-15,17-18H2,(H,27,30)/p+1