Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(C=C2SC3=NN=C(CCC(=O)NC4=CC(Cl)=C(Cl)C=C4)N3C2=O)C=C1
InChIKey
InChIKey=AADOIMISQIGMMK-UHFFFAOYSA-N
Formula
C20H13Cl2N5O4S
Mass
490.32
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Nitrobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Nitrobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Nitrobenzenes
Alternative Parents
Anilides Triazolothiazoles Dichlorobenzenes N-arylamides Nitroaromatic compounds Aryl chlorides Fatty amides Heteroaromatic compounds Triazoles Thiazoles Secondary carboxylic acid amides Lactams Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic zwitterions Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrobenzene - Anilide - Nitroaromatic compound - 1,2-dichlorobenzene - Triazolothiazole - N-arylamide - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Fatty amide - Fatty acyl - Heteroaromatic compound - 1,2,4-triazole - Thiazole - Azole - Organic nitro compound - Secondary carboxylic acid amide - Carboxamide group - Lactam - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Carboxylic acid derivative - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organic salt - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
External Descriptors
Not available