Compound Identification
SMILES
COC1=C(OC(=O)C2=C(Cl)C3=CC=CC=C3S2)C=CC(C=NNC(=O)C2=CC=CC=C2Br)=C1
InChIKey
InChIKey=PQMGPVSMMKHLFY-UHFFFAOYSA-N
Formula
C24H16BrClN2O4S
Mass
543.82
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
2-halobenzoic acids and derivatives 1-benzothiophenes Thiophene carboxylic acids and derivatives Phenoxy compounds Anisoles Methoxybenzenes Benzoyl derivatives Alkyl aryl ethers Bromobenzenes Aryl bromides Aryl chlorides Vinylogous halides Heteroaromatic compounds Carboxylic acid esters Hydrocarbon derivatives Organic oxides Organobromides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenol ester - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzothiophene - Benzoic acid or derivatives - 1-benzothiophene - Benzoyl - Phenol ether - Thiophene carboxylic acid or derivatives - Phenoxy compound - Anisole - Methoxybenzene - Bromobenzene - Alkyl aryl ether - Halobenzene - Aryl chloride - Monocyclic benzene moiety - Aryl bromide - Aryl halide - Thiophene - Vinylogous halide - Heteroaromatic compound - Carboxylic acid ester - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organic oxygen 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