4-(furan-2-ylcarbonyl)-1-(2-morpholin-4-ium-4-ylethyl)-5-pyridin-1-ium-3-yl-pyrrolidine-2,3-dione

Systemtic Name: 4-(furan-2-ylcarbonyl)-1-(2-morpholin-4-ium-4-ylethyl)-5-pyridin-1-ium-3-yl-pyrrolidine-2,3-dione Openeye Name: 4-(furan-2-carbonyl)-1-(2-morpholin-4-ium-4-ylethyl)-5-pyridin-1-ium-3-yl-pyrrolidine-2,3-dione CAS Name: 4-[2-furanyl(oxo)methyl]-1-[2-(4-morpholin-4-iumyl)ethyl]-5-(3-pyridin-1-iumyl)pyrrolidine-2,3-dione IUPAC Name: 4-(furan-2-carbonyl)-1-(2-morpholin-4-ium-4-ylethyl)-5-pyridin-1-ium-3-ylpyrrolidine-2,3-dione Traditional Name: 4-(2-furoyl)-1-(2-morpholin-4-ium-4-ylethyl)-5-pyridin-1-ium-3-yl-pyrrolidine-2,3-quinone Formula: C20H23N3O5+2 MolecularWeight: 385.41372

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN2C(C(C(=O)C2=O)C(=O)C3=CC=CO3)C4=C[NH+]=CC=C4

Isomeric SMILES

C1COCC[NH+]1CCN2C(C(C(=O)C2=O)C(=O)C3=CC=CO3)C4=C[NH+]=CC=C4

InChI

InChI=1S/C20H21N3O5/c24-18(15-4-2-10-28-15)16-17(14-3-1-5-21-13-14)23(20(26)19(16)25)7-6-22-8-11-27-12-9-22/h1-5,10,13,16-17H,6-9,11-12H2/p+2