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4-(2-chloroethylsulfanyl)-1-nitro-2-(trifluoromethyl)benzene

4-(2-chloroethylsulfanyl)-1-nitro-2-(trifluoromethyl)benzene

Systemtic Name:4-(2-chloroethylsulfanyl)-1-nitro-2-(trifluoromethyl)benzene
Openeye Name:4-(2-chloroethylsulfanyl)-1-nitro-2-(trifluoromethyl)benzene
CAS Name:4-(2-chloroethylthio)-1-nitro-2-(trifluoromethyl)benzene
IUPAC Name:4-(2-chloroethylsulfanyl)-1-nitro-2-(trifluoromethyl)benzene
Traditional Name:4-(2-chloroethylthio)-1-nitro-2-(trifluoromethyl)benzene
Formula: C9H7ClF3NO2S
MolecularWeight: 285.67059
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1SCCCl)C(F)(F)F)[N+](=O)[O-]


Isomeric SMILES

C1=CC(=C(C=C1SCCCl)C(F)(F)F)[N+](=O)[O-]


InChI

InChI=1S/C9H7ClF3NO2S/c10-3-4-17-6-1-2-8(14(15)16)7(5-6)9(11,12)13/h1-2,5H,3-4H2


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