Structure Information
Structure

Compound Identification

SMILES

COC1=C(NC(=O)CN(C)CC2=CC(=O)OC3=C2C=CC(O)=C3)C=C(Cl)C=C1

InChIKey

InChIKey=SRNDVPVBFFIUME-UHFFFAOYSA-N

Formula

C20H19ClN2O5

Mass

402.83

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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

7-hydroxycoumarins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

7-hydroxycoumarin - Alpha-amino acid amide - Alpha-amino acid or derivatives - Benzopyran - 1-benzopyran - Anilide - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - N-arylamide - Methoxybenzene - Aralkylamine - Alkyl aryl ether - Chlorobenzene - Halobenzene - Phenol - Pyranone - 1-hydroxy-2-unsubstituted benzenoid - Pyran - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Lactone - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Ether - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Amine - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 7-hydroxycoumarins. These are coumarins that contain one or more hydroxyl groups attached to the C7 position the coumarin skeleton.

External Descriptors

Not available

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