(5-cyano-2-fluoranyl-phenyl)methyl 2,4-dimethyl-6-oxidanylidene-pyran-3-carboxylate

Systemtic Name: (5-cyano-2-fluoranyl-phenyl)methyl 2,4-dimethyl-6-oxidanylidene-pyran-3-carboxylate Openeye Name: (5-cyano-2-fluoro-phenyl)methyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate CAS Name: 2,4-dimethyl-6-oxo-3-pyrancarboxylic acid (5-cyano-2-fluorophenyl)methyl ester IUPAC Name: (5-cyano-2-fluorophenyl)methyl 2,4-dimethyl-6-oxopyran-3-carboxylate Traditional Name: 6-keto-2,4-dimethyl-pyran-3-carboxylic acid (5-cyano-2-fluoro-benzyl) ester Formula: C16H12FNO4 MolecularWeight: 301.269183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC(=C1C(=O)OCC2=C(C=CC(=C2)C#N)F)C

Isomeric SMILES

CC1=CC(=O)OC(=C1C(=O)OCC2=C(C=CC(=C2)C#N)F)C

InChI

InChI=1S/C16H12FNO4/c1-9-5-14(19)22-10(2)15(9)16(20)21-8-12-6-11(7-18)3-4-13(12)17/h3-6H,8H2,1-2H3