Structure Information
Structure

Compound Identification

SMILES

CC[C@@H](CO)NCCN[C@@H](CC)COC(=O)C1=C(O)C=C(N)C=C1

InChIKey

InChIKey=QAEOITLNHNZSIR-KBPBESRZSA-N

Formula

C17H29N3O4

Mass

339.436

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

O-hydroxybenzoic acid ester - Aminosalicylic acid or derivatives - Salicylic acid or derivatives - Aminobenzoic acid or derivatives - Benzoyl - Aminophenol - Aniline or substituted anilines - M-aminophenol - Phenol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Vinylogous acid - 1,2-aminoalcohol - Carboxylic acid ester - Amino acid or derivatives - Carboxylic acid derivative - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Primary alcohol - Primary amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Alcohol - 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

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