(5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methyl pyridine-2-carboxylate

Systemtic Name: (5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methyl pyridine-2-carboxylate Openeye Name: (5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methyl pyridine-2-carboxylate CAS Name: 2-pyridinecarboxylic acid (5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methyl ester IUPAC Name: (5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methyl pyridine-2-carboxylate Traditional Name: picolinic acid (5-keto-8H-thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methyl ester Formula: C13H10N3O3S+ MolecularWeight: 288.3018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(=O)OCC2=CC(=O)[N+]3=C(N2)SC=C3

Isomeric SMILES

C1=CC=NC(=C1)C(=O)OCC2=CC(=O)[N+]3=C(N2)SC=C3

InChI

InChI=1S/C13H9N3O3S/c17-11-7-9(15-13-16(11)5-6-20-13)8-19-12(18)10-3-1-2-4-14-10/h1-7H,8H2/p+1