Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=NN(C(C(C)C)=C1C(NC1=CN(C)C(=O)C(Cl)=C1)C1=CC=C(C=C1)C#N)C1=CN=C(N=C1OC)N(C)C(=O)OC(C)(C)C

InChIKey

InChIKey=DEQAICGHPKOZMO-UHFFFAOYSA-N

Formula

C34H39ClN8O6

Mass

691.19

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Pyrazoles

Intermediate Tree Nodes

Not available

Direct Parent

Pyrazole carboxylic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Pyrazole-5-carboxylic acid or derivatives - Pyrazole-3-carboxylic acid or derivatives - Benzonitrile - Alkyl aryl ether - Dihydropyridine - Aminopyridine - Pyridinone - Secondary aliphatic/aromatic amine - Aralkylamine - Hydropyridine - Aryl chloride - Aryl halide - Pyridine - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Heteroaromatic compound - Carbamic acid ester - Lactam - Carboxylic acid ester - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Secondary amine - Ether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organooxygen compound - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organonitrogen compound - Organochloride - Cyanide - Organic oxide - Organohalogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as pyrazole carboxylic acids and derivatives. These are heterocyclic compounds containing a pyrazole ring in which a hydrogen atom is replaced by a carboxylic acid group.

External Descriptors

Not available

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