Compound Identification
SMILES
CCN(CC)S(=O)(=O)C1=CC=C(NC(=O)COC(=O)C2=C(O)C=CC(=C2)S(=O)(=O)NC2=CC=C(OC)C=C2)C=C1
InChIKey
InChIKey=BDOYXDAAMLHNJB-UHFFFAOYSA-N
Formula
C26H29N3O9S2
Mass
591.65
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Benzoic acid esters
- Level 6 o-Hydroxybenzoic acid esters
-
Level 5
Benzoic acid esters
-
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
Benzoic acid esters
Direct Parent
o-Hydroxybenzoic acid esters
Alternative Parents
Sulfanilides Salicylic acid and derivatives Benzenesulfonamides Anilides Methoxyanilines Benzenesulfonyl compounds Phenoxy compounds Anisoles N-arylamides Methoxybenzenes Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Organosulfonamides Vinylogous acids Aminosulfonyl compounds Carboxylic acid esters Secondary carboxylic acid amides Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
O-hydroxybenzoic acid ester - Sulfanilide - Salicylic acid or derivatives - Benzenesulfonamide - Anilide - Methoxyaniline - Benzenesulfonyl group - Phenoxy compound - N-arylamide - Phenol ether - Anisole - Benzoyl - Methoxybenzene - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Alkyl aryl ether - Organosulfonic acid amide - Vinylogous acid - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-hydroxybenzoic acid esters. These are benzoic acid esters where the benzene ring is ortho-substituted with a hydroxy group.
External Descriptors
Not available