methyl 2-cyano-3-(4-fluoranyl-2-methoxy-phenyl)-3-methyl-butanoate

Systemtic Name: methyl 2-cyano-3-(4-fluoranyl-2-methoxy-phenyl)-3-methyl-butanoate Openeye Name: methyl 2-cyano-3-(4-fluoro-2-methoxy-phenyl)-3-methyl-butanoate CAS Name: 2-cyano-3-(4-fluoro-2-methoxyphenyl)-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-cyano-3-(4-fluoro-2-methoxyphenyl)-3-methylbutanoate Traditional Name: 2-cyano-3-(4-fluoro-2-methoxy-phenyl)-3-methyl-butyric acid methyl ester Formula: C14H16FNO3 MolecularWeight: 265.280143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=C(C=C(C=C1)F)OC)C(C#N)C(=O)OC

Isomeric SMILES

CC(C)(C1=C(C=C(C=C1)F)OC)C(C#N)C(=O)OC

InChI

InChI=1S/C14H16FNO3/c1-14(2,11(8-16)13(17)19-4)10-6-5-9(15)7-12(10)18-3/h5-7,11H,1-4H3