Structure Information
Structure

Compound Identification

SMILES

CN(C1=CC=C(Cl)C=C1)C1=C\C(C(=O)C=C1)=C1/NC(N)=C(C=C1)C(=O)NCCCN1CCOCC1

InChIKey

InChIKey=DXIFZRYZSMDOEJ-GHVJWSGMSA-N

Formula

C26H30ClN5O3

Mass

496.01

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones - Quinomethanes

Direct Parent

O-quinomethanes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

O-quinomethane - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Chlorobenzene - Dihydropyridine - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Hydropyridine - Morpholine - Oxazinane - Benzenoid - Vinylogous amide - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Ketene acetal or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Dialkyl ether - Azacycle - Enamine - Ether - Oxacycle - Hydrocarbon derivative - Amine - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.

External Descriptors

Not available

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