N-methyl-N-[4-nitro-2-(trichloromethyl)phenyl]sulfanyl-methanamine

Systemtic Name: N-methyl-N-[4-nitro-2-(trichloromethyl)phenyl]sulfanyl-methanamine Openeye Name: N-methyl-N-[4-nitro-2-(trichloromethyl)phenyl]sulfanyl-methanamine CAS Name: N,N-dimethyl-4-nitro-2-(trichloromethyl)benzenesulfenamide IUPAC Name: N-methyl-N-[4-nitro-2-(trichloromethyl)phenyl]sulfanylmethanamine Traditional Name: dimethyl-[[4-nitro-2-(trichloromethyl)phenyl]thio]amine Formula: C9H9Cl3N2O2S MolecularWeight: 315.60396

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)SC1=C(C=C(C=C1)[N+](=O)[O-])C(Cl)(Cl)Cl

Isomeric SMILES

CN(C)SC1=C(C=C(C=C1)[N+](=O)[O-])C(Cl)(Cl)Cl

InChI

InChI=1S/C9H9Cl3N2O2S/c1-13(2)17-8-4-3-6(14(15)16)5-7(8)9(10,11)12/h3-5H,1-2H3