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2,7-dinitro-5-(trifluoromethyl)dibenzothiophen-5-ium

2,7-dinitro-5-(trifluoromethyl)dibenzothiophen-5-ium

Systemtic Name:2,7-dinitro-5-(trifluoromethyl)dibenzothiophen-5-ium
Openeye Name:2,7-dinitro-5-(trifluoromethyl)dibenzothiophen-5-ium
CAS Name:2,7-dinitro-5-(trifluoromethyl)dibenzothiophen-5-ium
IUPAC Name:2,7-dinitro-5-(trifluoromethyl)dibenzothiophen-5-ium
Traditional Name:2,7-dinitro-5-(trifluoromethyl)dibenzothiophen-5-ium
Formula: C13H6F3N2O4S+
MolecularWeight: 343.25795
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])[S+](C3=C2C=C(C=C3)[N+](=O)[O-])C(F)(F)F


Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])[S+](C3=C2C=C(C=C3)[N+](=O)[O-])C(F)(F)F


InChI

InChI=1S/C13H6F3N2O4S/c14-13(15,16)23-11-4-2-7(17(19)20)5-10(11)9-3-1-8(18(21)22)6-12(9)23/h1-6H/q+1


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