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

Systemtic Name: (E)-N-(3-chloranyl-4-fluoranyl-phenyl)-2-cyano-3-(4-hexoxyphenyl)prop-2-enamide Openeye Name: (E)-N-(3-chloro-4-fluoro-phenyl)-2-cyano-3-(4-hexoxyphenyl)prop-2-enamide CAS Name: (E)-N-(3-chloro-4-fluorophenyl)-2-cyano-3-(4-hexoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(3-chloro-4-fluorophenyl)-2-cyano-3-(4-hexoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(3-chloro-4-fluoro-phenyl)-2-cyano-3-(4-hexoxyphenyl)acrylamide Formula: C22H22ClFN2O2 MolecularWeight: 400.873683

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C22H22ClFN2O2/c1-2-3-4-5-12-28-19-9-6-16(7-10-19)13-17(15-25)22(27)26-18-8-11-21(24)20(23)14-18/h6-11,13-14H,2-5,12H2,1H3,(H,26,27)/b17-13+