Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)ON\C(=C1\C=C(Cl)C(=CC1=O)C#N)C1=C(O)C=CC=N1

InChIKey

InChIKey=OFAYUIQFWCUAKO-PTNGSMBKSA-N

Formula

C17H16ClN3O3

Mass

345.78

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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 - Hydroxypyridine - Pyridine - Vinylogous amide - Heteroaromatic compound - Carbonitrile - Nitrile - Vinyl chloride - Vinyl halide - Organoheterocyclic compound - Haloalkene - Chloroalkene - N-organohydroxylamine - Azacycle - Organic nitrogen compound - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Cyanide - Hydrocarbon derivative - 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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