Structure Information
Structure

Compound Identification

SMILES

CC[NH+](CC)CCCN1C(C2=C(OC3=C(C=C(Cl)C=C3)C2=O)C1=O)C1=CC=C(C)C=C1

InChIKey

InChIKey=UNUOVCHSUPVQHH-UHFFFAOYSA-O

Formula

C25H28ClN2O3

Mass

439.96

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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

Chromones

Alternative Parents

2-heteroaryl carboxamides Toluenes Pyranones and derivatives Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Quaternary ammonium salts Lactams Amino acids and derivatives Trialkylamines Azacyclic compounds Oxacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Organooxygen compounds Organic cations

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Chromone - 2-heteroaryl carboxamide - Pyranone - Toluene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyran - Benzenoid - Heteroaromatic compound - Tertiary carboxylic acid amide - Quaternary ammonium salt - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxamide group - Lactam - Oxacycle - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Amine - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as chromones. These are compounds containing a benzopyran-4-one moiety.

External Descriptors

Not available

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