methyl 5-cyano-1-[2-(4-fluorophenyl)-2-oxidanyl-ethyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-1-[2-(4-fluorophenyl)-2-oxidanyl-ethyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 5-cyano-1-[2-(4-fluorophenyl)-2-hydroxy-ethyl]-6-oxo-pyridine-3-carboxylate CAS Name: 5-cyano-1-[2-(4-fluorophenyl)-2-hydroxyethyl]-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-cyano-1-[2-(4-fluorophenyl)-2-hydroxyethyl]-6-oxopyridine-3-carboxylate Traditional Name: 5-cyano-1-[2-(4-fluorophenyl)-2-hydroxy-ethyl]-6-keto-nicotinic acid methyl ester Formula: C16H13FN2O4 MolecularWeight: 316.283823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13FN2O4/c1-23-16(22)12-6-11(7-18)15(21)19(8-12)9-14(20)10-2-4-13(17)5-3-10/h2-6,8,14,20H,9H2,1H3