3-chloranyl-1-oxidanidyl-6-(trifluoromethyl)-1,2,4-benzotriazin-1-ium

Systemtic Name: 3-chloranyl-1-oxidanidyl-6-(trifluoromethyl)-1,2,4-benzotriazin-1-ium Openeye Name: 3-chloro-1-oxido-6-(trifluoromethyl)-1,2,4-benzotriazin-1-ium CAS Name: 3-chloro-1-oxido-6-(trifluoromethyl)-1,2,4-benzotriazin-1-ium IUPAC Name: 3-chloro-1-oxido-6-(trifluoromethyl)-1,2,4-benzotriazin-1-ium Traditional Name: 3-chloro-1-oxido-6-(trifluoromethyl)-1,2,4-benzotriazin-1-ium Formula: C8H3ClF3N3O MolecularWeight: 249.57713

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(F)(F)F)N=C(N=[N+]2[O-])Cl

Isomeric SMILES

C1=CC2=C(C=C1C(F)(F)F)N=C(N=[N+]2[O-])Cl

InChI

InChI=1S/C8H3ClF3N3O/c9-7-13-5-3-4(8(10,11)12)1-2-6(5)15(16)14-7/h1-3H