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2-[[2,6-dinitro-4-(trifluoromethyl)phenyl]-(2-methylpropyl)amino]propanenitrile

2-[[2,6-dinitro-4-(trifluoromethyl)phenyl]-(2-methylpropyl)amino]propanenitrile

Systemtic Name:2-[[2,6-dinitro-4-(trifluoromethyl)phenyl]-(2-methylpropyl)amino]propanenitrile
Openeye Name:2-[N-isobutyl-2,6-dinitro-4-(trifluoromethyl)anilino]propanenitrile
CAS Name:2-[N-(2-methylpropyl)-2,6-dinitro-4-(trifluoromethyl)anilino]propanenitrile
IUPAC Name:2-[N-(2-methylpropyl)-2,6-dinitro-4-(trifluoromethyl)anilino]propanenitrile
Traditional Name:2-[N-isobutyl-2,6-dinitro-4-(trifluoromethyl)anilino]propionitrile
Formula: C14H15F3N4O4
MolecularWeight: 360.28851
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C14H15F3N4O4/c1-8(2)7-19(9(3)6-18)13-11(20(22)23)4-10(14(15,16)17)5-12(13)21(24)25/h4-5,8-9H,7H2,1-3H3


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