Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(C=C1)C1OB(OCC1NC(=O)C(Cl)Cl)C1=CC=C(Br)C=C1
InChIKey
InChIKey=FVERVTOVAHPSNK-UHFFFAOYSA-N
Formula
C17H14BBrCl2N2O5
Mass
487.92
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
Nitroaromatic compounds Bromobenzenes Aryl bromides Boronic acid esters Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic metalloid salts Organic oxoazanium compounds Organic oxides Organic zwitterions Organobromides Hydrocarbon derivatives Carbonyl compounds Organochlorides Organometalloid compounds Organonitrogen compounds Alkyl chlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Nitrobenzene - Nitroaromatic compound - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Boronic acid ester - Boronic acid derivative - Organic nitro compound - Carboxamide group - C-nitro compound - Secondary carboxylic acid amide - Oxacycle - Organic metalloid salt - Carboxylic acid derivative - Organoheterocyclic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic metalloid moeity - Organohalogen compound - Organic oxygen compound - Organic salt - Organic nitrogen compound - Alkyl halide - Carbonyl group - Organic oxide - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic zwitterion - Alkyl chloride - 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