methyl 5-[[(2-cyano-3-fluoranyl-phenyl)amino]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[(2-cyano-3-fluoranyl-phenyl)amino]methyl]furan-2-carboxylate Openeye Name: methyl 5-[(2-cyano-3-fluoro-anilino)methyl]furan-2-carboxylate CAS Name: 5-[(2-cyano-3-fluoroanilino)methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(2-cyano-3-fluoroanilino)methyl]furan-2-carboxylate Traditional Name: 5-[(2-cyano-3-fluoro-anilino)methyl]furan-2-carboxylic acid methyl ester Formula: C14H11FN2O3 MolecularWeight: 274.247143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CNC2=C(C(=CC=C2)F)C#N

Isomeric SMILES

COC(=O)C1=CC=C(O1)CNC2=C(C(=CC=C2)F)C#N

InChI

InChI=1S/C14H11FN2O3/c1-19-14(18)13-6-5-9(20-13)8-17-12-4-2-3-11(15)10(12)7-16/h2-6,17H,8H2,1H3