Compound Identification
SMILES
COC1=CC2=C(C=C1)C(Cl)=C(S2)C(=O)OC1=C(Cl)C=C(Cl)C=C1
InChIKey
InChIKey=PBPGTHGIWNRTPH-UHFFFAOYSA-N
Formula
C16H9Cl3O3S
Mass
387.66
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
1-benzothiophenes Thiophene carboxylic acids and derivatives Phenoxy compounds Dichlorobenzenes Anisoles Alkyl aryl ethers Aryl chlorides Vinylogous halides Heteroaromatic compounds Carboxylic acid esters Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenol ester - 1-benzothiophene - Benzothiophene - Phenoxy compound - Anisole - 1,3-dichlorobenzene - Thiophene carboxylic acid or derivatives - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Vinylogous halide - Heteroaromatic compound - Thiophene - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organochloride - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Aromatic heteropolycyclic 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