Compound Identification
SMILES
[O-][N+](=O)C1=CC(=C(C=C1C(=O)NCCC1=NC=CN1)N1CC1)[N+]([O-])=O
InChIKey
InChIKey=OQSWRUGLTWDFFX-UHFFFAOYSA-N
Formula
C14H14N6O5
Mass
346.303
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
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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 Imidazoles Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives 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 - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Azole - Imidazole - Heteroaromatic compound - Organic nitro compound - Amino acid or derivatives - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - C-nitro compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Aziridine - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Organic oxide - Organic zwitterion - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic salt - Organooxygen compound - Organic oxygen compound - Organonitrogen compound - 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