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2-cyclohexylsulfanyl-1,3-dinitro-5-(trifluoromethyl)benzene

2-cyclohexylsulfanyl-1,3-dinitro-5-(trifluoromethyl)benzene

Systemtic Name:2-cyclohexylsulfanyl-1,3-dinitro-5-(trifluoromethyl)benzene
Openeye Name:2-cyclohexylsulfanyl-1,3-dinitro-5-(trifluoromethyl)benzene
CAS Name:2-(cyclohexylthio)-1,3-dinitro-5-(trifluoromethyl)benzene
IUPAC Name:2-cyclohexylsulfanyl-1,3-dinitro-5-(trifluoromethyl)benzene
Traditional Name:2-(cyclohexylthio)-1,3-dinitro-5-(trifluoromethyl)benzene
Formula: C13H13F3N2O4S
MolecularWeight: 350.31353
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]


Isomeric SMILES

C1CCC(CC1)SC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]


InChI

InChI=1S/C13H13F3N2O4S/c14-13(15,16)8-6-10(17(19)20)12(11(7-8)18(21)22)23-9-4-2-1-3-5-9/h6-7,9H,1-5H2


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