3-[4-(furan-2-ylcarbonyl)-2,3-bis(oxidanylidene)-5-pyridin-1-ium-3-yl-pyrrolidin-1-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[4-(furan-2-ylcarbonyl)-2,3-bis(oxidanylidene)-5-pyridin-1-ium-3-yl-pyrrolidin-1-yl]propyl-dimethyl-azanium Openeye Name: 3-[4-(furan-2-carbonyl)-2,3-dioxo-5-pyridin-1-ium-3-yl-pyrrolidin-1-yl]propyl-dimethyl-ammonium CAS Name: 3-[4-[2-furanyl(oxo)methyl]-2,3-dioxo-5-(3-pyridin-1-iumyl)-1-pyrrolidinyl]propyl-dimethylammonium IUPAC Name: 3-[4-(furan-2-carbonyl)-2,3-dioxo-5-pyridin-1-ium-3-ylpyrrolidin-1-yl]propyl-dimethylazanium Traditional Name: 3-[4-(2-furoyl)-2,3-diketo-5-pyridin-1-ium-3-yl-pyrrolidino]propyl-dimethyl-ammonium Formula: C19H23N3O4+2 MolecularWeight: 357.40362

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN1C(C(C(=O)C1=O)C(=O)C2=CC=CO2)C3=C[NH+]=CC=C3

Isomeric SMILES

C[NH+](C)CCCN1C(C(C(=O)C1=O)C(=O)C2=CC=CO2)C3=C[NH+]=CC=C3

InChI

InChI=1S/C19H21N3O4/c1-21(2)9-5-10-22-16(13-6-3-8-20-12-13)15(18(24)19(22)25)17(23)14-7-4-11-26-14/h3-4,6-8,11-12,15-16H,5,9-10H2,1-2H3/p+2