Structure Information
Structure

Compound Identification

SMILES

OC(CC([O-])=O)(CC([O-])=O)C([O-])=O.CN(C)CCCOC1=NN(CC2=CC=C(Cl)C=C2)C2=C1C=CC(Cl)=C2

InChIKey

InChIKey=WSAPITHWHYPWOK-UHFFFAOYSA-K

Formula

C25H26Cl2N3O8

Mass

567.4

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzopyrazoles

Subclass

Indazoles

Intermediate Tree Nodes

Not available

Direct Parent

Indazoles

Alternative Parents

Molecular Framework

Not available

Substituents

Benzopyrazole - Indazole - Tricarboxylic acid or derivatives - Chlorobenzene - Halobenzene - Alkyl aryl ether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary alcohol - Pyrazole - Azole - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid salt - Carboxylic acid derivative - Carboxylic acid - Ether - Azacycle - Organochloride - Carbonyl group - Alcohol - Organic oxide - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organohalogen compound - Organooxygen compound - Organic anion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as indazoles. These are compounds containing an indazole, which is structurally characterized by a pyrazole fused to a benzene.

External Descriptors

Not available

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