Compound Identification
SMILES
COC1=C(OC(=O)C2=CC=CO2)C(Br)=CC(C=C2C(=N)N3C=CSC3=NC2=O)=C1
InChIKey
InChIKey=DQGPGSSOWNFRIB-UHFFFAOYSA-N
Formula
C19H12BrN3O5S
Mass
474.29
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
Furoic acid esters Phenoxy compounds Anisoles Methoxybenzenes Pyrimidones Alkyl aryl ethers Bromobenzenes Aryl bromides Imidolactams Hydropyrimidines Thiazolines Heteroaromatic compounds N-acylimines Isothioureas Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Carboxamidines Carboximidamides Carbonyl compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenol ester - Furoic acid ester - Anisole - Phenol ether - Methoxybenzene - Phenoxy compound - Furoic acid or derivatives - Halobenzene - Pyrimidone - Bromobenzene - Alkyl aryl ether - 1,4,5,6-tetrahydropyrimidine - Hydropyrimidine - Pyrimidine - Aryl bromide - Aryl halide - Imidolactam - Monocyclic benzene moiety - Furan - Heteroaromatic compound - Meta-thiazoline - N-acylimine - Carboxylic acid ester - Isothiourea - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid amidine - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Ether - Carboximidamide - Amidine - Organic oxygen compound - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organobromide - 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