methyl 5-cyano-1-[(3-fluorophenyl)methyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-1-[(3-fluorophenyl)methyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 5-cyano-1-[(3-fluorophenyl)methyl]-6-oxo-pyridine-3-carboxylate CAS Name: 5-cyano-1-[(3-fluorophenyl)methyl]-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-cyano-1-[(3-fluorophenyl)methyl]-6-oxopyridine-3-carboxylate Traditional Name: 5-cyano-1-(3-fluorobenzyl)-6-keto-nicotinic acid methyl ester Formula: C15H11FN2O3 MolecularWeight: 286.257843

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C(=C1)C#N)CC2=CC(=CC=C2)F

Isomeric SMILES

COC(=O)C1=CN(C(=O)C(=C1)C#N)CC2=CC(=CC=C2)F

InChI

InChI=1S/C15H11FN2O3/c1-21-15(20)12-6-11(7-17)14(19)18(9-12)8-10-3-2-4-13(16)5-10/h2-6,9H,8H2,1H3