Compound Identification
SMILES
CC(=O)OC1=C(C)C(N(CC=C)C(C)=O)=C(OC(C)=O)C(Br)=C1N(CC=C)C(C)=O
InChIKey
InChIKey=URXAXQIKGYHSKF-UHFFFAOYSA-N
Formula
C21H25BrN2O6
Mass
481.343
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Anilides
-
Level 5
Acetanilides
-
Level 6
Haloacetanilides
- Level 7 O-haloacetanilides
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Level 6
Haloacetanilides
-
Level 5
Acetanilides
-
Subclass
Anilides
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Anilides
Intermediate Tree Nodes
Acetanilides - Haloacetanilides
Direct Parent
O-haloacetanilides
Alternative Parents
M-haloacetanilides Phenol esters P-toluquinols and derivatives Diaminotoluenes Phenoxy compounds Bromobenzenes Aryl bromides Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Acetamides Carboxylic acid esters Organic oxides Organopnictogen compounds Carbonyl compounds Organobromides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
O-haloacetanilide - M-haloacetanilide - Phenol ester - Diaminotoluene - P-toluquinol or derivatives - Phenoxy compound - Bromobenzene - Halobenzene - Toluene - Aryl bromide - Aryl halide - Dicarboxylic acid or derivatives - Acetamide - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Carboxylic acid derivative - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-haloacetanilides. These are organic compounds containing an acetamide group conjugated to a phenyl group, which is in turn ortho-substituted with a halogen atom.
External Descriptors
Not available