Compound Identification
SMILES
CS(=O)(=O)OCCN(CCCl)C1=C(C(C(=O)NCCCO)=C(C=C1)[N+]([O-])=O)[N+]([O-])=O
InChIKey
InChIKey=LOHNWIILSUAXFV-UHFFFAOYSA-N
Formula
C15H21ClN4O9S
Mass
468.86
Taxonomic Classification
Taxonomy Tree
-
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 Nitrobenzenes Benzoyl derivatives Dialkylarylamines Nitroaromatic compounds Sulfonic acid esters Organosulfonic acid esters Methanesulfonates Sulfonyls Secondary carboxylic acid amides Amino acids and derivatives Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Alkanolamines Organic salts Organic oxides Alkyl chlorides Primary alcohols Hydrocarbon derivatives Organic zwitterions Organochlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Dinitroaniline - Aminobenzamide - Aminobenzoic acid or derivatives - Nitrobenzene - Benzamide - Benzoic acid or derivatives - Nitroaromatic compound - Dialkylarylamine - Benzoyl - Tertiary aliphatic/aromatic amine - Sulfonic acid ester - Organosulfonic acid ester - Organic sulfonic acid or derivatives - Methanesulfonate - Organosulfonic acid or derivatives - Sulfonyl - Tertiary amine - C-nitro compound - Carboxamide group - Organic nitro compound - Secondary carboxylic acid amide - Amino acid or derivatives - Alkanolamine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organosulfur compound - Primary alcohol - Organic zwitterion - Amine - Alkyl halide - Alkyl chloride - Alcohol - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic 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