Structure Information
Structure

Compound Identification

SMILES

CCC([O-])=O.CC1=NC=CN1C1=NC(=C(CC2=CC=CC=C2)O1)C1=CC=C(Cl)C=C1

InChIKey

InChIKey=QYDOEPSJUDUBFO-UHFFFAOYSA-M

Formula

C23H21ClN3O3

Mass

422.89

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Oxazoles

Intermediate Tree Nodes

Not available

Direct Parent

Phenyl-1,3-oxazoles

Alternative Parents

Molecular Framework

Not available

Substituents

Phenyl-1,3-oxazole - 2,4,5-trisubstituted 1,3-oxazole - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Heteroaromatic compound - Imidazole - Carboxylic acid salt - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organooxygen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organic anion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenyl-1,3-oxazoles. These are aromatic heterocyclic compounds containing a 1,3-oxazole substituted at one or more positions by a phenyl group.

External Descriptors

Not available

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