(2S)-1-(furan-2-ylcarbonyl)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-(furan-2-ylcarbonyl)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-1-(furan-2-carbonyl)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-[2-furanyl(oxo)methyl]-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(furan-2-carbonyl)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-(2-furoyl)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]pyrrolidine-2-carboxamide Formula: C20H25N4O4+ MolecularWeight: 385.4369

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC=CO2)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC=CO2)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

InChI

InChI=1S/C20H24N4O4/c25-19(16-3-1-7-24(16)20(26)17-4-2-10-28-17)22-14-15-5-6-18(21-13-15)23-8-11-27-12-9-23/h2,4-6,10,13,16H,1,3,7-9,11-12,14H2,(H,22,25)/p+1/t16-/m0/s1