Compound Identification
SMILES
OC(=O)C1=CC=C(NN=CC2=CC=C(O2)C2=CC(=C(Cl)C=C2)[N+]([O-])=O)C=C1
InChIKey
InChIKey=HWHHMQINJMMQNU-UHFFFAOYSA-N
Formula
C18H12ClN3O5
Mass
385.76
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
Benzoic acids Phenylhydrazines Benzoyl derivatives Nitroaromatic compounds Chlorobenzenes Aryl chlorides Furans Heteroaromatic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Hydrazones Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Organic oxides Organochlorides Hydrocarbon derivatives Organooxygen compounds Organopnictogen compounds Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoic acid or derivatives - Benzoic acid - Nitrobenzene - Nitroaromatic compound - Benzoyl - Phenylhydrazine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Heteroaromatic compound - Furan - Organic nitro compound - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Organoheterocyclic compound - Hydrazone - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic 1,3-dipolar compound - Organic oxygen compound - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organic salt - Organohalogen compound - Organic oxide - Organochloride - Organonitrogen compound - Organooxygen compound - Organic zwitterion - 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