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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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