Compound Identification
SMILES
[O-]C(Cl)=O.CC(C)(C)OC(=O)C(O)C1=CC=CC=C1[N+]([O-])=O
InChIKey
InChIKey=NIUOILAFQXWFLQ-UHFFFAOYSA-M
Formula
C13H15ClNO7
Mass
332.71
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
Nitroaromatic compounds Secondary alcohols Organic carbonic acids and derivatives Carboxylic acid esters Organic oxoazanium compounds Monocarboxylic acids and derivatives Organonitrogen compounds Organochlorides Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols Organic cations
Molecular Framework
Not available
Substituents
Nitrobenzene - Nitroaromatic compound - Carboxylic acid ester - C-nitro compound - Carbonic acid derivative - Secondary alcohol - Organic nitro compound - Monocarboxylic acid or derivatives - Organic oxoazanium - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Organochloride - Aromatic alcohol - Organohalogen compound - Carbonyl group - Organic nitrogen compound - Organic salt - Alcohol - Hydrocarbon derivative - Organic cation - 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