Compound Identification
SMILES
CN(C)C1=C(C=C(C=C1[N+]([O-])=O)N1C(=O)C2ON(CC3=C(C=C(C=C3)C(N)=O)[N+]([O-])=O)C(C2C1=O)C1=CC=CC=C1C#N)[N+]([O-])=O
InChIKey
InChIKey=YMWIGGHEZJPFRX-UHFFFAOYSA-N
Formula
C28H22N8O10
Mass
630.53
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
Phenylisoxazolidines Phenylpyrrolidines Benzamides Nitrobenzenes Benzonitriles Benzoyl derivatives Dialkylarylamines Nitroaromatic compounds Pyrrolidine-2-ones N-substituted carboxylic acid imides Dicarboximides Pyrroles Primary carboxylic acid amides Lactams Amino acids and derivatives N-organohydroxylamines Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Nitriles Oxacyclic compounds Hydrocarbon derivatives Organic zwitterions Carbonyl compounds Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dinitroaniline - Phenylisoxazolidine - 1-phenylpyrrolidine - Benzamide - Benzoic acid or derivatives - Nitrobenzene - Nitroaromatic compound - Benzonitrile - Benzoyl - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Carboxylic acid imide, n-substituted - Pyrrolidone - 2-pyrrolidone - Carboxylic acid imide - Dicarboximide - Isoxazolidine - Pyrrole - Pyrrolidine - Amino acid or derivatives - Lactam - Carboxamide group - C-nitro compound - Primary carboxylic acid amide - Organic nitro compound - Tertiary amine - Azacycle - Organic 1,3-dipolar compound - Organic oxoazanium - Oxacycle - Allyl-type 1,3-dipolar organic compound - Nitrile - Carbonitrile - Propargyl-type 1,3-dipolar organic compound - N-organohydroxylamine - Carboxylic acid derivative - Organoheterocyclic compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic nitrogen compound - Aromatic heteropolycyclic 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