N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-cyano-3-(4-hexoxyphenyl)prop-2-enamide

Systemtic Name: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-cyano-3-(4-hexoxyphenyl)prop-2-enamide Openeye Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-(4-hexoxyphenyl)prop-2-enamide CAS Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-(4-hexoxyphenyl)-2-propenamide IUPAC Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-(4-hexoxyphenyl)prop-2-enamide Traditional Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-(4-hexoxyphenyl)acrylamide Formula: C23H22ClF3N2O2 MolecularWeight: 450.88119

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22ClF3N2O2/c1-2-3-4-5-12-31-19-9-6-16(7-10-19)13-17(15-28)22(30)29-21-14-18(23(25,26)27)8-11-20(21)24/h6-11,13-14H,2-5,12H2,1H3,(H,29,30)