Compound Identification
SMILES
COC1=C(OC)C=C(CCNC(=O)COC(=O)C2=CC=C(CSC3=CC=C(Cl)C=C3)C=C2)C=C1
InChIKey
InChIKey=UTWULVTUJMEZHI-UHFFFAOYSA-N
Formula
C26H26ClNO5S
Mass
500.01
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
Dimethoxybenzenes Anisoles Benzoyl derivatives Thiophenol ethers Phenoxy compounds Alkyl aryl ethers Chlorobenzenes Alkylarylthioethers Aryl chlorides Carboxylic acid esters Secondary carboxylic acid amides Sulfenyl compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
O-dimethoxybenzene - Dimethoxybenzene - Benzoate ester - Phenoxy compound - Aryl thioether - Anisole - Methoxybenzene - Thiophenol ether - Benzoyl - Phenol ether - Alkyl aryl ether - Alkylarylthioether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Ether - Carboxylic acid derivative - Thioether - Sulfenyl compound - Organohalogen compound - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available