Compound Identification
SMILES
Cl.CCCCNC1=CC(O)=C(C=C1)C(=O)OC1CCCCC1N(CC)CC
InChIKey
InChIKey=CMJZNMFCWSRQSO-UHFFFAOYSA-N
Formula
C21H35ClN2O3
Mass
398.97
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
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Level 5
Benzoic acid esters
- Level 6 o-Hydroxybenzoic acid esters
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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
Benzoic acid esters
Direct Parent
o-Hydroxybenzoic acid esters
Alternative Parents
Aminosalicylic acids and derivatives Aminobenzoic acids and derivatives m-Aminophenols Aniline and substituted anilines Benzoyl derivatives Phenylalkylamines Cyclohexylamines 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Secondary alkylarylamines Vinylogous acids Carboxylic acid esters Amino acids and derivatives Trialkylamines Organic oxides Hydrochlorides Hydrocarbon derivatives Organooxygen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
O-hydroxybenzoic acid ester - Aminosalicylic acid or derivatives - Salicylic acid or derivatives - Aminobenzoic acid or derivatives - Benzoyl - Aniline or substituted anilines - Phenylalkylamine - Aminophenol - M-aminophenol - Phenol - Cyclohexylamine - Secondary aliphatic/aromatic amine - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Vinylogous acid - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Secondary amine - Organic nitrogen compound - Amine - Hydrochloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - 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