Compound Identification
SMILES
[O-][N+](=O)C1=CC(=CC(=C1N1CCN(CC1)C1=C(Cl)C(=O)N(N=C1)C1=CC(Cl)=CC=C1)[N+]([O-])=O)C(F)(F)F
InChIKey
InChIKey=LZSNCMZLOWSMEM-UHFFFAOYSA-N
Formula
C21H15Cl2F3N6O5
Mass
559.28
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
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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 Pyridazinones Aminopyridazines Chlorobenzenes Aryl chlorides Vinylogous amides Heteroaromatic compounds Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organochlorides Organofluorides Organooxygen compounds Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Dinitroaniline - Phenylpiperazine - N-arylpiperazine - Trifluoromethylbenzene - Nitrobenzene - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aminopyridazine - Chlorobenzene - Halobenzene - Pyridazinone - Aryl chloride - Aryl halide - 1,4-diazinane - Piperazine - Pyridazine - Vinylogous amide - Heteroaromatic compound - Organic nitro compound - Lactam - C-nitro compound - Tertiary amine - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organic oxoazanium - Organic oxide - Organohalogen compound - Organic nitrogen compound - Organic salt - Amine - Hydrocarbon derivative - Alkyl halide - Alkyl fluoride - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic zwitterion - 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