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

Systemtic Name: methyl 6-oxidanylidene-1-(pyridin-2-ylmethyl)pyridine-3-carboxylate Openeye Name: methyl 6-oxo-1-(2-pyridylmethyl)pyridine-3-carboxylate CAS Name: 6-oxo-1-(2-pyridinylmethyl)-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-oxo-1-(pyridin-2-ylmethyl)pyridine-3-carboxylate Traditional Name: 6-keto-1-(2-pyridylmethyl)nicotinic acid methyl ester Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C=C1)CC2=CC=CC=N2

Isomeric SMILES

COC(=O)C1=CN(C(=O)C=C1)CC2=CC=CC=N2

InChI

InChI=1S/C13H12N2O3/c1-18-13(17)10-5-6-12(16)15(8-10)9-11-4-2-3-7-14-11/h2-8H,9H2,1H3