Structure Information
Structure

Compound Identification

SMILES

OC1=C(C=CC2=C1C=C(CN1CCOCC1)C(=O)O2)C(=O)NCC1=CC=C(Cl)C=C1

InChIKey

InChIKey=DLCACEHZFRTZSO-UHFFFAOYSA-N

Formula

C22H21ClN2O5

Mass

428.87

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Coumarins and derivatives

Subclass

Hydroxycoumarins

Intermediate Tree Nodes

Not available

Direct Parent

Hydroxycoumarins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Hydroxycoumarin - Salicylic acid or derivatives - 1-benzopyran - Benzopyran - Pyranone - Chlorobenzene - Halobenzene - Aralkylamine - Phenol - 1-hydroxy-4-unsubstituted benzenoid - Aryl chloride - Morpholine - Oxazinane - Benzenoid - Pyran - Monocyclic benzene moiety - Aryl halide - Heteroaromatic compound - Vinylogous acid - Tertiary aliphatic amine - Amino acid or derivatives - Secondary carboxylic acid amide - Tertiary amine - Carboxamide group - Lactone - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Oxacycle - Ether - Dialkyl ether - Organooxygen compound - Amine - Organohalogen compound - Organochloride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as hydroxycoumarins. These are coumarins that contain one or more hydroxyl groups attached to the coumarin skeleton.

External Descriptors

Not available

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