4-bromanyl-2-[3-(trifluoromethyl)phenyl]benzotriazol-5-amine

Systemtic Name: 4-bromanyl-2-[3-(trifluoromethyl)phenyl]benzotriazol-5-amine Openeye Name: 4-bromo-2-[3-(trifluoromethyl)phenyl]benzotriazol-5-amine CAS Name: 4-bromo-2-[3-(trifluoromethyl)phenyl]-5-benzotriazolamine IUPAC Name: 4-bromo-2-[3-(trifluoromethyl)phenyl]benzotriazol-5-amine Traditional Name: [4-bromo-2-[3-(trifluoromethyl)phenyl]benzotriazol-5-yl]amine Formula: C13H8BrF3N4 MolecularWeight: 357.12863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2N=C3C=CC(=C(C3=N2)Br)N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)N2N=C3C=CC(=C(C3=N2)Br)N)C(F)(F)F

InChI

InChI=1S/C13H8BrF3N4/c14-11-9(18)4-5-10-12(11)20-21(19-10)8-3-1-2-7(6-8)13(15,16)17/h1-6H,18H2