(E)-2-[2,3-bis(fluoranyl)phenyl]carbonyl-3-[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]prop-2-enenitrile

Systemtic Name: (E)-2-[2,3-bis(fluoranyl)phenyl]carbonyl-3-[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]prop-2-enenitrile Openeye Name: (E)-2-(2,3-difluorobenzoyl)-3-[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]prop-2-enenitrile CAS Name: (E)-2-[(2,3-difluorophenyl)-oxomethyl]-3-[4-[3-(trifluoromethyl)-1-pyrazolyl]phenyl]-2-propenenitrile IUPAC Name: (E)-2-(2,3-difluorobenzoyl)-3-[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]prop-2-enenitrile Traditional Name: (E)-2-(2,3-difluorobenzoyl)-3-[4-[3-(trifluoromethyl)pyrazol-1-yl]phenyl]acrylonitrile Formula: C20H10F5N3O MolecularWeight: 403.304916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)F)C(=O)C(=CC2=CC=C(C=C2)N3C=CC(=N3)C(F)(F)F)C#N

Isomeric SMILES

C1=CC(=C(C(=C1)F)F)C(=O)/C(=C/C2=CC=C(C=C2)N3C=CC(=N3)C(F)(F)F)/C#N

InChI

InChI=1S/C20H10F5N3O/c21-16-3-1-2-15(18(16)22)19(29)13(11-26)10-12-4-6-14(7-5-12)28-9-8-17(27-28)20(23,24)25/h1-10H/b13-10+