2-[1-[[4-(trifluoromethyl)phenyl]amino]phthalazin-6-yl]benzenecarbonitrile

Systemtic Name: 2-[1-[[4-(trifluoromethyl)phenyl]amino]phthalazin-6-yl]benzenecarbonitrile Openeye Name: 2-[1-[4-(trifluoromethyl)anilino]phthalazin-6-yl]benzonitrile CAS Name: 2-[1-[4-(trifluoromethyl)anilino]-6-phthalazinyl]benzonitrile IUPAC Name: 2-[1-[4-(trifluoromethyl)anilino]phthalazin-6-yl]benzonitrile Traditional Name: 2-[1-[4-(trifluoromethyl)anilino]phthalazin-6-yl]benzonitrile Formula: C22H13F3N4 MolecularWeight: 390.36063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)C2=CC3=CN=NC(=C3C=C2)NC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C#N)C2=CC3=CN=NC(=C3C=C2)NC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C22H13F3N4/c23-22(24,25)17-6-8-18(9-7-17)28-21-20-10-5-14(11-16(20)13-27-29-21)19-4-2-1-3-15(19)12-26/h1-11,13H,(H,28,29)