Structure Information
Structure

Compound Identification

SMILES

OC1=C(O)C=C(CCNC2=C3C=CC(Cl)=CC3=NC=C2)C=C1

InChIKey

InChIKey=DWSNZLLFABJSRZ-UHFFFAOYSA-N

Formula

C17H15ClN2O2

Mass

314.77

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenols

Subclass

Benzenediols

Intermediate Tree Nodes

Catechols

Direct Parent

Catecholamines and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aminoquinoline - Catecholamine - Chloroquinoline - Haloquinoline - 4-aminoquinoline - Quinoline - Phenethylamine - Aminopyridine - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Secondary aliphatic/aromatic amine - 1-hydroxy-4-unsubstituted benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Secondary amine - Organohalogen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as catecholamines and derivatives. These are compounds containing 4-(2-Aminoethyl)pyrocatechol [4-(2-aminoethyl)benzene-1,2-diol] or a derivative thereof formed by substitution.

External Descriptors

Not available

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