Compound Identification
SMILES
COC(=O)C1=C(O)C=CC(=C1)C(O)CN1CCC(CC1)N1C(=O)NC2=CC=CC=C12
InChIKey
InChIKey=NQYRSYDBGGSHBM-UHFFFAOYSA-N
Formula
C22H25N3O5
Mass
411.458
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
Salicylic acid and derivatives Benzimidazoles Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids Aralkylamines Piperidines N-substituted imidazoles Vinylogous acids Methyl esters Heteroaromatic compounds Ureas Trialkylamines Secondary alcohols 1,2-aminoalcohols Amino acids and derivatives Azacyclic compounds Aromatic alcohols Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
O-hydroxybenzoic acid ester - Salicylic acid or derivatives - Benzimidazole - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Phenol - N-substituted imidazole - Piperidine - Azole - Imidazole - Heteroaromatic compound - Vinylogous acid - Methyl ester - 1,2-aminoalcohol - Amino acid or derivatives - Carboxylic acid ester - Urea - Secondary alcohol - Tertiary amine - Tertiary aliphatic amine - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organonitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Organooxygen compound - Aromatic alcohol - Alcohol - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic 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