4-(benzotriazol-1-yl)-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-(benzotriazol-1-yl)-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-(benzotriazol-1-yl)-2-(trifluoromethyl)benzonitrile CAS Name: 4-(1-benzotriazolyl)-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-(benzotriazol-1-yl)-2-(trifluoromethyl)benzonitrile Traditional Name: 4-(benzotriazol-1-yl)-2-(trifluoromethyl)benzonitrile Formula: C14H7F3N4 MolecularWeight: 288.22739

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C3=CC(=C(C=C3)C#N)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2C3=CC(=C(C=C3)C#N)C(F)(F)F

InChI

InChI=1S/C14H7F3N4/c15-14(16,17)11-7-10(6-5-9(11)8-18)21-13-4-2-1-3-12(13)19-20-21/h1-7H