[2-[1,2-bis(oxidanyl)ethyl]-4-oxidanyl-5-oxidanylidene-2H-furan-3-yl] pyridine-3-carboxylate

Systemtic Name: [2-[1,2-bis(oxidanyl)ethyl]-4-oxidanyl-5-oxidanylidene-2H-furan-3-yl] pyridine-3-carboxylate Openeye Name: [2-(1,2-dihydroxyethyl)-4-hydroxy-5-oxo-2H-furan-3-yl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-(1,2-dihydroxyethyl)-4-hydroxy-5-oxo-2H-furan-3-yl] ester IUPAC Name: [2-(1,2-dihydroxyethyl)-4-hydroxy-5-oxo-2H-furan-3-yl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-(1,2-dihydroxyethyl)-4-hydroxy-5-keto-2H-furan-3-yl] ester Formula: C12H11NO7 MolecularWeight: 281.21824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)OC2=C(C(=O)OC2C(CO)O)O

Isomeric SMILES

C1=CC(=CN=C1)C(=O)OC2=C(C(=O)OC2C(CO)O)O

InChI

InChI=1S/C12H11NO7/c14-5-7(15)9-10(8(16)12(18)19-9)20-11(17)6-2-1-3-13-4-6/h1-4,7,9,14-16H,5H2