Compound Identification
SMILES
CC1=C(C(=O)C(N)=O)C2=C(OCC(O)=O)C=C3CCCC3=C2N1CC1=CC=CC=C1Br
InChIKey
InChIKey=ZRGYYOLGPYAKHM-UHFFFAOYSA-N
Formula
C23H21BrN2O5
Mass
485.334
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenoxyacetic acid derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Phenoxyacetic acid derivatives
Alternative Parents
N-alkylindoles Indanes Indoles Aryl ketones Alkyl aryl ethers Bromobenzenes Substituted pyrroles Aryl bromides Heteroaromatic compounds Vinylogous amides Primary carboxylic acid amides Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxyacetate - N-alkylindole - Indole or derivatives - Indole - Indane - Aryl ketone - Halobenzene - Alkyl aryl ether - Bromobenzene - Substituted pyrrole - Aryl bromide - Aryl halide - Heteroaromatic compound - Vinylogous amide - Pyrrole - Carboxamide group - Ketone - Primary carboxylic acid amide - Carboxylic acid derivative - Carboxylic acid - Ether - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organobromide - Carbonyl group - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenoxyacetic acid derivatives. These are compounds containing an anisole where the methane group is linked to an acetic acid or a derivative.
External Descriptors
Not available