[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl] 6-oxidanylidene-1-phenyl-pyridine-3-carboxylate

Systemtic Name: [6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl] 6-oxidanylidene-1-phenyl-pyridine-3-carboxylate Openeye Name: [3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] 6-oxo-1-phenyl-pyridine-3-carboxylate CAS Name: 6-oxo-1-phenyl-3-pyridinecarboxylic acid [3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl] ester IUPAC Name: [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 6-oxo-1-phenylpyridine-3-carboxylate Traditional Name: 6-keto-1-phenyl-nicotinic acid (3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl) ester Formula: C18H19NO8 MolecularWeight: 377.34536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=CC2=O)C(=O)OC3C(C(C(C(O3)CO)O)O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=CC2=O)C(=O)OC3C(C(C(C(O3)CO)O)O)O

InChI

InChI=1S/C18H19NO8/c20-9-12-14(22)15(23)16(24)18(26-12)27-17(25)10-6-7-13(21)19(8-10)11-4-2-1-3-5-11/h1-8,12,14-16,18,20,22-24H,9H2