(E)-3-(3-butoxy-4-methoxy-phenyl)-N-(3-chloranyl-4-fluoranyl-phenyl)-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-(3-butoxy-4-methoxy-phenyl)-N-(3-chloranyl-4-fluoranyl-phenyl)-2-cyano-prop-2-enamide Openeye Name: (E)-3-(3-butoxy-4-methoxy-phenyl)-N-(3-chloro-4-fluoro-phenyl)-2-cyano-prop-2-enamide CAS Name: (E)-3-(3-butoxy-4-methoxyphenyl)-N-(3-chloro-4-fluorophenyl)-2-cyano-2-propenamide IUPAC Name: (E)-3-(3-butoxy-4-methoxyphenyl)-N-(3-chloro-4-fluorophenyl)-2-cyanoprop-2-enamide Traditional Name: (E)-3-(3-butoxy-4-methoxy-phenyl)-N-(3-chloro-4-fluoro-phenyl)-2-cyano-acrylamide Formula: C21H20ClFN2O3 MolecularWeight: 402.846503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC(=C(C=C2)F)Cl)OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NC2=CC(=C(C=C2)F)Cl)OC

InChI

InChI=1S/C21H20ClFN2O3/c1-3-4-9-28-20-11-14(5-8-19(20)27-2)10-15(13-24)21(26)25-16-6-7-18(23)17(22)12-16/h5-8,10-12H,3-4,9H2,1-2H3,(H,25,26)/b15-10+