Compound Identification
SMILES
OC(=O)CCOC1=CC=C(C=C1)C1=NC2=C(C3=C(CCCCC3)S2)C(=O)N1
InChIKey
InChIKey=XNTDWZDLSIVURQ-UHFFFAOYSA-N
Formula
C20H20N2O4S
Mass
384.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass 3-phenoxypropionic acids
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
3-phenoxypropionic acids
Intermediate Tree Nodes
Not available
Direct Parent
3-phenoxypropionic acids
Alternative Parents
Thienopyrimidines Phenoxy compounds Phenol ethers Pyrimidones Alkyl aryl ethers Thiophenes Heteroaromatic compounds Lactams Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenoxypropionic acid - Thienopyrimidine - Phenoxy compound - Phenol ether - Alkyl aryl ether - Pyrimidone - Pyrimidine - Heteroaromatic compound - Thiophene - Lactam - Azacycle - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-phenoxypropionic acids. These are aromatic compounds containing a 3-phenoxypropionic acid.
External Descriptors
Not available