Structure Information
Structure

Compound Identification

SMILES

O[C@H](CNCCC1=CC2=C(OCC3=C2C=CC(=C3)C(O)=O)C=C1)C1=CC(Cl)=CC=C1

InChIKey

InChIKey=PCJGQABDEKXDBU-JOCHJYFZSA-N

Formula

C24H22ClNO4

Mass

423.89

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzopyrans

Subclass

1-benzopyrans

Intermediate Tree Nodes

Not available

Direct Parent

Dibenzopyrans

Alternative Parents

2-benzopyrans Phenethylamines Alkyl aryl ethers Aralkylamines Chlorobenzenes Aryl chlorides 1,2-aminoalcohols Secondary alcohols Amino acids Dialkylamines Carboxylic acids Oxacyclic compounds Hydrocarbon derivatives Aromatic alcohols Organic oxides Organochlorides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dibenzopyran - 2-benzopyran - Phenethylamine - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aralkylamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Secondary alcohol - Amino acid or derivatives - 1,2-aminoalcohol - Amino acid - Oxacycle - Secondary amine - Carboxylic acid derivative - Ether - Carboxylic acid - Secondary aliphatic amine - Amine - Organic oxygen compound - Organic oxide - Organohalogen compound - Organic nitrogen compound - Alcohol - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic alcohol - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dibenzopyrans. These are organic heterocyclic compounds with a structure containing a dibenzopyran moiety, made up of two benzene rings fused to a central pyran ring.

External Descriptors

Not available

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