(E)-N-(3-chloranyl-4-fluoranyl-phenyl)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)prop-2-enamide

Systemtic Name: (E)-N-(3-chloranyl-4-fluoranyl-phenyl)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)prop-2-enamide Openeye Name: (E)-N-(3-chloro-4-fluoro-phenyl)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxy-phenyl)prop-2-enamide CAS Name: (E)-N-(3-chloro-4-fluorophenyl)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(3-chloro-4-fluorophenyl)-2-cyano-3-(3-ethoxy-4-prop-2-ynoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(3-chloro-4-fluoro-phenyl)-2-cyano-3-(3-ethoxy-4-propargyloxy-phenyl)acrylamide Formula: C21H16ClFN2O3 MolecularWeight: 398.814743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC(=C(C=C2)F)Cl)OCC#C

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NC2=CC(=C(C=C2)F)Cl)OCC#C

InChI

InChI=1S/C21H16ClFN2O3/c1-3-9-28-19-8-5-14(11-20(19)27-4-2)10-15(13-24)21(26)25-16-6-7-18(23)17(22)12-16/h1,5-8,10-12H,4,9H2,2H3,(H,25,26)/b15-10+