Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(NC2=CC3=C(C=C2)C(N)=NO3)C2=C(O1)C=NC=C2

InChIKey

InChIKey=ZOCVUQLFLRLHCF-UHFFFAOYSA-N

Formula

C17H14N4O4

Mass

338.323

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzisoxazoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzisoxazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Furoic acid ester - Furo[2,3-c]pyridine - Furopyridine - Benzisoxazole - Furoic acid or derivatives - Imidolactam - Benzenoid - Primary aromatic amine - Pyridine - Azole - Heteroaromatic compound - Furan - Isoxazole - Vinylogous amide - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Oxacycle - Azacycle - Secondary amine - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Organonitrogen compound - Organooxygen compound - Primary amine - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzisoxazoles. These are aromatic compounds containing a benzene ring fused to an isoxazole ring. Isoxazole is five-membered ring with three carbon atoms, and an oxygen atom next to a nitrogen atom.

External Descriptors

Not available

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