Compound Identification
SMILES
COC1=CC(C=NNC2=CC=C(C=C2)[N+]([O-])=O)=CC(CC=C)=C1OCC1=CC=C(C=C1)C(O)=O
InChIKey
InChIKey=WIRYKTUZYWQACV-UHFFFAOYSA-N
Formula
C25H23N3O6
Mass
461.474
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 Phenoxy compounds Anisoles Benzoyl derivatives Methoxybenzenes Nitroaromatic compounds Alkyl aryl ethers Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Carboxylic acids Hydrazones Organic salts Organic zwitterions Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzoic acid or derivatives - Benzoic acid - Nitrobenzene - Anisole - Phenoxy compound - Benzoyl - Nitroaromatic compound - Phenol ether - Phenylhydrazine - Methoxybenzene - Alkyl aryl ether - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Carboxylic acid - Ether - Hydrazone - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Organic zwitterion - Organic salt - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic homomonocyclic 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