4-[1,1,1-tris(fluoranyl)hexadecan-2-ylamino]benzenecarbonitrile

Systemtic Name: 4-[1,1,1-tris(fluoranyl)hexadecan-2-ylamino]benzenecarbonitrile Openeye Name: 4-[1-(trifluoromethyl)pentadecylamino]benzonitrile CAS Name: 4-(1,1,1-trifluorohexadecan-2-ylamino)benzonitrile IUPAC Name: 4-(1,1,1-trifluorohexadecan-2-ylamino)benzonitrile Traditional Name: 4-[1-(trifluoromethyl)pentadecylamino]benzonitrile Formula: C23H35F3N2 MolecularWeight: 396.53261

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(F)(F)F)NC1=CC=C(C=C1)C#N

Isomeric SMILES

CCCCCCCCCCCCCCC(C(F)(F)F)NC1=CC=C(C=C1)C#N

InChI

InChI=1S/C23H35F3N2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-22(23(24,25)26)28-21-17-15-20(19-27)16-18-21/h15-18,22,28H,2-14H2,1H3