Compound Identification
SMILES
[O-][N+](=O)C1=CC(=CC(=C1N1CC[NH2+]CC1)[N+]([O-])=O)C(F)(F)F
InChIKey
InChIKey=ADMOXSJPOKMGFZ-UHFFFAOYSA-O
Formula
C11H12F3N4O4
Mass
321.236
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Aniline and substituted anilines
- Level 5 Dinitroanilines
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Subclass
Aniline and substituted anilines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Aniline and substituted anilines
Intermediate Tree Nodes
Not available
Direct Parent
Dinitroanilines
Alternative Parents
Phenylpiperazines N-arylpiperazines Trifluoromethylbenzenes Nitrobenzenes Dialkylarylamines Nitroaromatic compounds Quaternary ammonium salts Azacyclic compounds Dialkylamines Organic oxoazanium compounds Alkyl fluorides Hydrocarbon derivatives Organic oxides Organic salts Organofluorides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Dinitroaniline - Phenylpiperazine - N-arylpiperazine - Trifluoromethylbenzene - Nitrobenzene - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Dialkylarylamine - 1,4-diazinane - Piperazine - Quaternary ammonium salt - C-nitro compound - Organic nitro compound - Tertiary amine - Organoheterocyclic compound - Secondary aliphatic amine - Organic oxoazanium - Azacycle - Secondary amine - Organic oxide - Organonitrogen compound - Organofluoride - Organic salt - Organohalogen compound - Organic oxygen compound - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Alkyl halide - Amine - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as dinitroanilines. These are organic compounds containing an aniline moiety, which is substituted at 2 positions by a nitro group.
External Descriptors
Not available