Compound Identification
SMILES
NC(=O)C1=CC(=C(N2CC2)C(=C1)[N+]([O-])=O)[N+]([O-])=O
InChIKey
InChIKey=NYNKICKUYWHEGX-UHFFFAOYSA-N
Formula
C9H8N4O5
Mass
252.186
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
Aminobenzamides Benzamides Phenylaziridines Indoles Nitrobenzenes Benzoyl derivatives Dialkylarylamines Nitroaromatic compounds Amino acids and derivatives Primary carboxylic acid amides Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic zwitterions Organooxygen compounds Hydrocarbon derivatives Organic oxides Organic salts
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Dinitroaniline - Aminobenzamide - Aminobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Indole - Nitrobenzene - Phenylaziridine - Nitroaromatic compound - Benzoyl - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Amino acid or derivatives - Carboxamide group - Organic nitro compound - C-nitro compound - Primary carboxylic acid amide - Tertiary amine - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Aziridine - Organic 1,3-dipolar compound - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxoazanium - Amine - Organic zwitterion - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic salt - 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