N-[4-nitro-2-(trichloromethyl)phenyl]sulfanylpropan-1-amine

Systemtic Name: N-[4-nitro-2-(trichloromethyl)phenyl]sulfanylpropan-1-amine Openeye Name: N-[4-nitro-2-(trichloromethyl)phenyl]sulfanylpropan-1-amine CAS Name: 4-nitro-N-propyl-2-(trichloromethyl)benzenesulfenamide IUPAC Name: N-[4-nitro-2-(trichloromethyl)phenyl]sulfanylpropan-1-amine Traditional Name: [[4-nitro-2-(trichloromethyl)phenyl]thio]-propyl-amine Formula: C10H11Cl3N2O2S MolecularWeight: 329.63054

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Descriptors Computed from Structure

Canonical SMILES:

CCCNSC1=C(C=C(C=C1)[N+](=O)[O-])C(Cl)(Cl)Cl

Isomeric SMILES

CCCNSC1=C(C=C(C=C1)[N+](=O)[O-])C(Cl)(Cl)Cl

InChI

InChI=1S/C10H11Cl3N2O2S/c1-2-5-14-18-9-4-3-7(15(16)17)6-8(9)10(11,12)13/h3-4,6,14H,2,5H2,1H3