Structure Information
Structure

Compound Identification

SMILES

CC(=O)NC1=NN(CC2=CC=CC=C2)C(=O)C1=O

InChIKey

InChIKey=OTGMPKPMMHSVHP-UHFFFAOYSA-N

Formula

C12H11N3O3

Mass

245.238

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azolines

Subclass

Pyrazolines

Intermediate Tree Nodes

Not available

Direct Parent

Pyrazolones

Alternative Parents

Benzene and substituted derivatives Acetamides Cyclic ketones Amidrazones Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Monocyclic benzene moiety - Pyrazolinone - Benzenoid - Acetamide - Carboxylic acid amidrazone - Ketone - Cyclic ketone - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as pyrazolones. These are compounds containing a pyrazole ring which bears a ketone.

External Descriptors

Not available

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