(E)-2-cyano-3-(3-ethoxy-2-propoxy-phenyl)-N-(4-fluorophenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(3-ethoxy-2-propoxy-phenyl)-N-(4-fluorophenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(3-ethoxy-2-propoxy-phenyl)-N-(4-fluorophenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(3-ethoxy-2-propoxyphenyl)-N-(4-fluorophenyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(3-ethoxy-2-propoxyphenyl)-N-(4-fluorophenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(3-ethoxy-2-propoxy-phenyl)-N-(4-fluorophenyl)acrylamide Formula: C21H21FN2O3 MolecularWeight: 368.401443

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC=C1OCC)C=C(C#N)C(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

CCCOC1=C(C=CC=C1OCC)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C21H21FN2O3/c1-3-12-27-20-15(6-5-7-19(20)26-4-2)13-16(14-23)21(25)24-18-10-8-17(22)9-11-18/h5-11,13H,3-4,12H2,1-2H3,(H,24,25)/b16-13+