Structure Information
Structure

Compound Identification

SMILES

[Cl-].CCN(CC)CC(O)CNC(=O)C1=NOC2=C1C=CC(=C2)[N+]([O-])=O

InChIKey

InChIKey=ICFXHDVKQIQBRR-UHFFFAOYSA-M

Formula

C15H20ClN4O5

Mass

371.8

Export to:

JSON SDF CSV

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

Benzisoxazole - 2-heteroaryl carboxamide - Nitroaromatic compound - Benzenoid - Azole - Heteroaromatic compound - Isoxazole - 1,2-aminoalcohol - Amino acid or derivatives - Carboxamide group - Organic nitro compound - C-nitro compound - Secondary alcohol - Secondary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Organic oxygen compound - Organic chloride salt - Amine - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic salt - Organic cation - 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

Previous Back Next