Compound Identification
SMILES
CC1=C(SC(NC2=CC=CC=C2Cl)=N1)C(=O)CC(=NNC1=C(C=C(C=C1)[N+]([O-])=O)[N+]([O-])=O)C(=O)NC1=C(C)C=C(C)C=C1
InChIKey
InChIKey=MHOTXJJSZSYHDV-UHFFFAOYSA-N
Formula
C28H24ClN7O6S
Mass
622.05
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Nitrobenzenes
-
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 Aryl alkyl ketones Aniline and substituted anilines N-arylamides Nitroaromatic compounds m-Xylenes 2,4,5-trisubstituted thiazoles Phenylhydrazines Chlorobenzenes Fatty amides Aryl chlorides 2-amino-1,3-thiazoles Heteroaromatic compounds Amino acids and derivatives Secondary carboxylic acid amides Organic oxoazanium compounds Azacyclic compounds Hydrazones Propargyl-type 1,3-dipolar organic compounds Secondary amines Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Anilide - 2,4,5-trisubstituted 1,3-thiazole - Nitroaromatic compound - Phenylhydrazine - M-xylene - Xylene - N-arylamide - Aryl ketone - Aryl alkyl ketone - Aniline or substituted anilines - Chlorobenzene - Halobenzene - Fatty acyl - 1,3-thiazol-2-amine - Aryl chloride - Aryl halide - Fatty amide - Heteroaromatic compound - Azole - Thiazole - Organic nitro compound - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Ketone - C-nitro compound - Organoheterocyclic compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Hydrazone - Secondary amine - Organic oxoazanium - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic salt - Carbonyl group - Organic oxide - Organic oxygen compound - Organohalogen compound - Organic zwitterion - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic 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