Structure Information
Structure

Compound Identification

SMILES

C[NH+](CC1=C(N=NN1C1=NON=C1N)C(=O)NNC=C1C=C(Cl)C=CC1=O)C1CCCCC1

InChIKey

InChIKey=BWIVDVLJSPBMDK-UHFFFAOYSA-O

Formula

C20H25ClN9O3

Mass

474.93

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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 - Cyclohexylamine - Aralkylamine - Imidolactam - Azole - Furazan - Oxadiazole - Quaternary ammonium salt - 1,2,3-triazole - Heteroaromatic compound - Vinylogous amide - Carboxylic acid hydrazide - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Azacycle - Chloroalkene - Haloalkene - Organoheterocyclic compound - Vinyl halide - Vinyl chloride - Carboxylic acid derivative - Organohalogen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Primary amine - Organic oxide - Amine - Hydrocarbon derivative - Organic cation - 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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