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2,4-dinitro-N-[2-(trifluoromethylsulfanyl)ethyl]aniline

2,4-dinitro-N-[2-(trifluoromethylsulfanyl)ethyl]aniline

Systemtic Name:2,4-dinitro-N-[2-(trifluoromethylsulfanyl)ethyl]aniline
Openeye Name:2,4-dinitro-N-[2-(trifluoromethylsulfanyl)ethyl]aniline
CAS Name:2,4-dinitro-N-[2-(trifluoromethylthio)ethyl]aniline
IUPAC Name:2,4-dinitro-N-[2-(trifluoromethylsulfanyl)ethyl]aniline
Traditional Name:(2,4-dinitrophenyl)-[2-(trifluoromethylthio)ethyl]amine
Formula: C9H8F3N3O4S
MolecularWeight: 311.23773
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NCCSC(F)(F)F


Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NCCSC(F)(F)F


InChI

InChI=1S/C9H8F3N3O4S/c10-9(11,12)20-4-3-13-7-2-1-6(14(16)17)5-8(7)15(18)19/h1-2,5,13H,3-4H2


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