(E)-2-cyano-3-(2,5-dimethoxy-4-pyrrolidin-1-yl-phenyl)-N-(4-fluorophenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(2,5-dimethoxy-4-pyrrolidin-1-yl-phenyl)-N-(4-fluorophenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(2,5-dimethoxy-4-pyrrolidin-1-yl-phenyl)-N-(4-fluorophenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[2,5-dimethoxy-4-(1-pyrrolidinyl)phenyl]-N-(4-fluorophenyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(2,5-dimethoxy-4-pyrrolidin-1-ylphenyl)-N-(4-fluorophenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(2,5-dimethoxy-4-pyrrolidino-phenyl)-N-(4-fluorophenyl)acrylamide Formula: C22H22FN3O3 MolecularWeight: 395.426783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=C(C#N)C(=O)NC2=CC=C(C=C2)F)OC)N3CCCC3

Isomeric SMILES

COC1=CC(=C(C=C1/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)F)OC)N3CCCC3

InChI

InChI=1S/C22H22FN3O3/c1-28-20-13-19(26-9-3-4-10-26)21(29-2)12-15(20)11-16(14-24)22(27)25-18-7-5-17(23)6-8-18/h5-8,11-13H,3-4,9-10H2,1-2H3,(H,25,27)/b16-11+