Compound Identification
SMILES
CC(=O)N[C@H](CC(O)=O)SC(=O)C1=CC=CC=C1OC(C)=O
InChIKey
InChIKey=NKETZBQITRSNRF-LBPRGKRZSA-N
Formula
C14H15NO6S
Mass
325.34
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Hydroxybenzoic acid derivatives
- Level 6 Salicylic acid and derivatives
-
Level 5
Hydroxybenzoic acid derivatives
-
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
Hydroxybenzoic acid derivatives - Salicylic acid and derivatives
Direct Parent
Acylsalicylic acids and derivatives
Alternative Parents
Beta amino acids and derivatives Phenol esters Thiobenzoic acids and derivatives Benzoyl derivatives Phenoxy compounds Dicarboxylic acids and derivatives Acetamides N,S-acetals Thioesters Secondary carboxylic acid amides Carboxylic acid esters Carbothioic S-esters Carboxylic acids Sulfenyl compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Acylsalicylic acid or derivatives - Beta amino acid or derivatives - Phenol ester - Thiobenzoic acid or derivatives - Benzoyl - Phenoxy compound - Dicarboxylic acid or derivatives - N,s-acetal - Acetamide - Carboxamide group - Carboxylic acid ester - Carbothioic s-ester - Secondary carboxylic acid amide - Thiocarboxylic acid ester - Carboxylic acid derivative - Carboxylic acid - Sulfenyl compound - Hemithioaminal - Thiocarboxylic acid or derivatives - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Carbonyl group - Organopnictogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as acylsalicylic acids and derivatives. These are salicylic acids or derivatives, that are O-acylated.
External Descriptors
Not available