N,N-dimethyl-2,6-dinitro-4-(trichloromethylsulfanyl)aniline

Systemtic Name: N,N-dimethyl-2,6-dinitro-4-(trichloromethylsulfanyl)aniline Openeye Name: N,N-dimethyl-2,6-dinitro-4-(trichloromethylsulfanyl)aniline CAS Name: N,N-dimethyl-2,6-dinitro-4-(trichloromethylthio)aniline IUPAC Name: N,N-dimethyl-2,6-dinitro-4-(trichloromethylsulfanyl)aniline Traditional Name: [2,6-dinitro-4-(trichloromethylthio)phenyl]-dimethyl-amine Formula: C9H8Cl3N3O4S MolecularWeight: 360.60152

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1[N+](=O)[O-])SC(Cl)(Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1[N+](=O)[O-])SC(Cl)(Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C9H8Cl3N3O4S/c1-13(2)8-6(14(16)17)3-5(20-9(10,11)12)4-7(8)15(18)19/h3-4H,1-2H3