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5-nitro-2-[3-(trifluoromethyl)phenyl]sulfanyl-benzenecarbonitrile

5-nitro-2-[3-(trifluoromethyl)phenyl]sulfanyl-benzenecarbonitrile

Systemtic Name:5-nitro-2-[3-(trifluoromethyl)phenyl]sulfanyl-benzenecarbonitrile
Openeye Name:5-nitro-2-[3-(trifluoromethyl)phenyl]sulfanyl-benzonitrile
CAS Name:5-nitro-2-[[3-(trifluoromethyl)phenyl]thio]benzonitrile
IUPAC Name:5-nitro-2-[3-(trifluoromethyl)phenyl]sulfanylbenzonitrile
Traditional Name:5-nitro-2-[[3-(trifluoromethyl)phenyl]thio]benzonitrile
Formula: C14H7F3N2O2S
MolecularWeight: 324.27779
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C(F)(F)F


Isomeric SMILES

C1=CC(=CC(=C1)SC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C(F)(F)F


InChI

InChI=1S/C14H7F3N2O2S/c15-14(16,17)10-2-1-3-12(7-10)22-13-5-4-11(19(20)21)6-9(13)8-18/h1-7H


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