2-[(4-cyanophenyl)amino]-2-(2-fluoranyl-3,5-dimethoxy-phenyl)ethanoate

Systemtic Name: 2-[(4-cyanophenyl)amino]-2-(2-fluoranyl-3,5-dimethoxy-phenyl)ethanoate Openeye Name: 2-(4-cyanoanilino)-2-(2-fluoro-3,5-dimethoxy-phenyl)acetate CAS Name: 2-(4-cyanoanilino)-2-(2-fluoro-3,5-dimethoxyphenyl)acetate IUPAC Name: 2-(4-cyanoanilino)-2-(2-fluoro-3,5-dimethoxyphenyl)acetate Traditional Name: 2-(4-cyanoanilino)-2-(2-fluoro-3,5-dimethoxy-phenyl)acetate Formula: C17H14FN2O4- MolecularWeight: 329.302463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)C(C(=O)[O-])NC2=CC=C(C=C2)C#N)F)OC

Isomeric SMILES

COC1=CC(=C(C(=C1)C(C(=O)[O-])NC2=CC=C(C=C2)C#N)F)OC

InChI

InChI=1S/C17H15FN2O4/c1-23-12-7-13(15(18)14(8-12)24-2)16(17(21)22)20-11-5-3-10(9-19)4-6-11/h3-8,16,20H,1-2H3,(H,21,22)/p-1