6-oxidanylidene-1-(pyridin-2-ylmethyl)pyridine-3-carboxylate

Systemtic Name: 6-oxidanylidene-1-(pyridin-2-ylmethyl)pyridine-3-carboxylate Openeye Name: 6-oxo-1-(2-pyridylmethyl)pyridine-3-carboxylate CAS Name: 6-oxo-1-(2-pyridinylmethyl)-3-pyridinecarboxylate IUPAC Name: 6-oxo-1-(pyridin-2-ylmethyl)pyridine-3-carboxylate Traditional Name: 6-keto-1-(2-pyridylmethyl)nicotinate Formula: C12H9N2O3- MolecularWeight: 229.21146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CN2C=C(C=CC2=O)C(=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)CN2C=C(C=CC2=O)C(=O)[O-]

InChI

InChI=1S/C12H10N2O3/c15-11-5-4-9(12(16)17)7-14(11)8-10-3-1-2-6-13-10/h1-7H,8H2,(H,16,17)/p-1