N-[4-nitro-2-(trichloromethyl)phenyl]sulfanylethanamine

Systemtic Name: N-[4-nitro-2-(trichloromethyl)phenyl]sulfanylethanamine Openeye Name: N-[4-nitro-2-(trichloromethyl)phenyl]sulfanylethanamine CAS Name: N-ethyl-4-nitro-2-(trichloromethyl)benzenesulfenamide IUPAC Name: N-[4-nitro-2-(trichloromethyl)phenyl]sulfanylethanamine Traditional Name: ethyl-[[4-nitro-2-(trichloromethyl)phenyl]thio]amine Formula: C9H9Cl3N2O2S MolecularWeight: 315.60396

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Descriptors Computed from Structure

Canonical SMILES:

CCNSC1=C(C=C(C=C1)[N+](=O)[O-])C(Cl)(Cl)Cl

Isomeric SMILES

CCNSC1=C(C=C(C=C1)[N+](=O)[O-])C(Cl)(Cl)Cl

InChI

InChI=1S/C9H9Cl3N2O2S/c1-2-13-17-8-4-3-6(14(15)16)5-7(8)9(10,11)12/h3-5,13H,2H2,1H3