Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=C(Cl)C=CC(=C1)C1OC2=C(C=C(Br)C=C2)C2CC(=NN12)C1=CC2=CC=CC=C2C=C1

InChIKey

InChIKey=WDUVWKUENFIAEY-UHFFFAOYSA-N

Formula

C26H17BrClN3O3

Mass

534.79

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzoxazines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzoxazines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzoxazine - Naphthalene - Nitrobenzene - Nitroaromatic compound - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrazoline - Organic nitro compound - C-nitro compound - Oxacycle - Azacycle - Hydrazone - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Organohalogen compound - Organic oxide - Organopnictogen compound - Organic salt - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzoxazines. These are organic compounds containing a benzene fused to an oxazine ring (a six-membered aliphatic ring with four carbon atoms, one oxygen atom, and one nitrogen atom).

External Descriptors

Not available

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