3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide

Systemtic Name: 3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide Openeye Name: 3-(3-bromo-4-hydroxy-5-methoxy-phenyl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide CAS Name: 3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-cyano-N-[3-(trifluoromethyl)phenyl]-2-propenamide IUPAC Name: 3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide Traditional Name: 3-(3-bromo-4-hydroxy-5-methoxy-phenyl)-2-cyano-N-[3-(trifluoromethyl)phenyl]acrylamide Formula: C18H12BrF3N2O3 MolecularWeight: 441.19869

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2=CC=CC(=C2)C(F)(F)F)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2=CC=CC(=C2)C(F)(F)F)Br)O

InChI

InChI=1S/C18H12BrF3N2O3/c1-27-15-7-10(6-14(19)16(15)25)5-11(9-23)17(26)24-13-4-2-3-12(8-13)18(20,21)22/h2-8,25H,1H3,(H,24,26)