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3-nitro-4-[3-(trifluoromethyl)piperidin-1-yl]benzenecarbonitrile

3-nitro-4-[3-(trifluoromethyl)piperidin-1-yl]benzenecarbonitrile

Systemtic Name:3-nitro-4-[3-(trifluoromethyl)piperidin-1-yl]benzenecarbonitrile
Openeye Name:3-nitro-4-[3-(trifluoromethyl)-1-piperidyl]benzonitrile
CAS Name:3-nitro-4-[3-(trifluoromethyl)-1-piperidinyl]benzonitrile
IUPAC Name:3-nitro-4-[3-(trifluoromethyl)piperidin-1-yl]benzonitrile
Traditional Name:3-nitro-4-[3-(trifluoromethyl)piperidino]benzonitrile
Formula: C13H12F3N3O2
MolecularWeight: 299.24849
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=C(C=C2)C#N)[N+](=O)[O-])C(F)(F)F


Isomeric SMILES

C1CC(CN(C1)C2=C(C=C(C=C2)C#N)[N+](=O)[O-])C(F)(F)F


InChI

InChI=1S/C13H12F3N3O2/c14-13(15,16)10-2-1-5-18(8-10)11-4-3-9(7-17)6-12(11)19(20)21/h3-4,6,10H,1-2,5,8H2


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