Compound Identification
SMILES
CCC(=O)OC1=C(Br)C=C(C=C2N=C(OC2=O)C2=C(Cl)C=CC(I)=C2)C=C1Br
InChIKey
InChIKey=KVNVXVIWYWLAPF-UHFFFAOYSA-N
Formula
C19H11Br2ClINO4
Mass
639.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Phenol esters
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol esters
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenol esters
Alternative Parents
Alpha amino acids and derivatives Phenoxy compounds 4-Hydrocarbylideneazlactones Iodobenzenes Bromobenzenes Chlorobenzenes Aryl bromides Aryl chlorides Aryl iodides Dicarboxylic acids and derivatives Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organochlorides Organoiodides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - Phenol ester - Phenoxy compound - 4-hydrocarbylideneazlactone - Halobenzene - Iodobenzene - Chlorobenzene - Bromobenzene - Aryl bromide - Aryl chloride - Aryl halide - Aryl iodide - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Oxazoline - Carboxylic acid ester - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Azacycle - Oxacycle - Organic nitrogen compound - Organohalogen compound - Organobromide - Organochloride - Organoiodide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenol esters. These are aromatic compounds containing a benzene ring substituted by a hydroxyl group and an ester group.
External Descriptors
Not available