Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=C(C=NC2=CC3=C(OC(=N3)C3=CC=C(Br)C=C3)C=C2)C=C1

InChIKey

InChIKey=DZHPXPHOYMTJMT-UHFFFAOYSA-N

Formula

C20H12BrN3O3

Mass

422.238

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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

Aromatic heteropolycyclic compounds

Substituents

Phenyl-1,3-oxazole - Nitrobenzene - Benzoxazole - Nitroaromatic compound - Halobenzene - Bromobenzene - Aryl bromide - Benzenoid - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Shiff base - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Aldimine - Organic oxoazanium - Azacycle - Oxacycle - Organic nitrogen compound - Organic oxygen compound - Organobromide - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Imine - Organic salt - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic cation - Aromatic heteropolycyclic 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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