5-[tris[3-(trifluoromethyl)phenyl]methyl]pyridine-2-carbonitrile

Systemtic Name: 5-[tris[3-(trifluoromethyl)phenyl]methyl]pyridine-2-carbonitrile Openeye Name: 5-[tris[3-(trifluoromethyl)phenyl]methyl]pyridine-2-carbonitrile CAS Name: 5-[tris[3-(trifluoromethyl)phenyl]methyl]-2-pyridinecarbonitrile IUPAC Name: 5-[tris[3-(trifluoromethyl)phenyl]methyl]pyridine-2-carbonitrile Traditional Name: 5-[tris[3-(trifluoromethyl)phenyl]methyl]picolinonitrile Formula: C28H15F9N2 MolecularWeight: 550.417729

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C(C2=CC(=CC=C2)C(F)(F)F)(C3=CC(=CC=C3)C(F)(F)F)C4=CN=C(C=C4)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C(C2=CC(=CC=C2)C(F)(F)F)(C3=CC(=CC=C3)C(F)(F)F)C4=CN=C(C=C4)C#N

InChI

InChI=1S/C28H15F9N2/c29-26(30,31)20-7-1-4-17(12-20)25(23-10-11-24(15-38)39-16-23,18-5-2-8-21(13-18)27(32,33)34)19-6-3-9-22(14-19)28(35,36)37/h1-14,16H