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

Systemtic Name: methyl 6-oxidanylidene-1-(pyridin-3-ylmethyl)pyridine-3-carboxylate Openeye Name: methyl 6-oxo-1-(3-pyridylmethyl)pyridine-3-carboxylate CAS Name: 6-oxo-1-(3-pyridinylmethyl)-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-oxo-1-(pyridin-3-ylmethyl)pyridine-3-carboxylate Traditional Name: 6-keto-1-(3-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=CN=CC=C2

Isomeric SMILES

COC(=O)C1=CN(C(=O)C=C1)CC2=CN=CC=C2

InChI

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