2-[(2S)-3-(furan-2-ylcarbonyl)-4-oxidanyl-5-oxidanylidene-2-pyridin-2-yl-2H-pyrrol-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(2S)-3-(furan-2-ylcarbonyl)-4-oxidanyl-5-oxidanylidene-2-pyridin-2-yl-2H-pyrrol-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[(2S)-3-(furan-2-carbonyl)-4-hydroxy-5-oxo-2-(2-pyridyl)-2H-pyrrol-1-yl]ethyl-dimethyl-ammonium CAS Name: 2-[(2S)-3-[2-furanyl(oxo)methyl]-4-hydroxy-5-oxo-2-(2-pyridinyl)-2H-pyrrol-1-yl]ethyl-dimethylammonium IUPAC Name: 2-[(2S)-3-(furan-2-carbonyl)-4-hydroxy-5-oxo-2-pyridin-2-yl-2H-pyrrol-1-yl]ethyl-dimethylazanium Traditional Name: 2-[(5S)-4-(2-furoyl)-3-hydroxy-2-keto-5-(2-pyridyl)-3-pyrrolin-1-yl]ethyl-dimethyl-ammonium Formula: C18H20N3O4+ MolecularWeight: 342.3691

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C(C(=C(C1=O)O)C(=O)C2=CC=CO2)C3=CC=CC=N3

Isomeric SMILES

C[NH+](C)CCN1[C@@H](C(=C(C1=O)O)C(=O)C2=CC=CO2)C3=CC=CC=N3

InChI

InChI=1S/C18H19N3O4/c1-20(2)9-10-21-15(12-6-3-4-8-19-12)14(17(23)18(21)24)16(22)13-7-5-11-25-13/h3-8,11,15,23H,9-10H2,1-2H3/p+1/t15-/m1/s1