2-(2-chlorophenyl)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]quinoline-4-carboxamide

Systemtic Name: 2-(2-chlorophenyl)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]quinoline-4-carboxamide Openeye Name: 2-(2-chlorophenyl)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]quinoline-4-carboxamide CAS Name: 2-(2-chlorophenyl)-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-4-quinolinecarboxamide IUPAC Name: 2-(2-chlorophenyl)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]quinoline-4-carboxamide Traditional Name: 2-(2-chlorophenyl)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]cinchoninamide Formula: C26H24ClN4O2+ MolecularWeight: 459.94736

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5Cl

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5Cl

InChI

InChI=1S/C26H23ClN4O2/c27-22-7-3-1-6-20(22)24-15-21(19-5-2-4-8-23(19)30-24)26(32)29-17-18-9-10-25(28-16-18)31-11-13-33-14-12-31/h1-10,15-16H,11-14,17H2,(H,29,32)/p+1