4-nitro-1-(trichloromethylsulfanyl)benzotriazole

Systemtic Name: 4-nitro-1-(trichloromethylsulfanyl)benzotriazole Openeye Name: 4-nitro-1-(trichloromethylsulfanyl)benzotriazole CAS Name: 4-nitro-1-(trichloromethylthio)benzotriazole IUPAC Name: 4-nitro-1-(trichloromethylsulfanyl)benzotriazole Traditional Name: 4-nitro-1-(trichloromethylthio)benzotriazole Formula: C7H3Cl3N4O2S MolecularWeight: 313.54832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)[N+](=O)[O-])N=NN2SC(Cl)(Cl)Cl

Isomeric SMILES

C1=CC2=C(C(=C1)[N+](=O)[O-])N=NN2SC(Cl)(Cl)Cl

InChI

InChI=1S/C7H3Cl3N4O2S/c8-7(9,10)17-13-4-2-1-3-5(14(15)16)6(4)11-12-13/h1-3H