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

Systemtic Name: 2-methyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]quinoline-4-carboxamide Openeye Name: 2-methyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]quinoline-4-carboxamide CAS Name: 2-methyl-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-4-quinolinecarboxamide IUPAC Name: 2-methyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]quinoline-4-carboxamide Traditional Name: 2-methyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]cinchoninamide Formula: C21H23N4O2+ MolecularWeight: 363.43292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

InChI

InChI=1S/C21H22N4O2/c1-15-12-18(17-4-2-3-5-19(17)24-15)21(26)23-14-16-6-7-20(22-13-16)25-8-10-27-11-9-25/h2-7,12-13H,8-11,14H2,1H3,(H,23,26)/p+1