Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(=CNC1=C(C=NC=C1)[N+]([O-])=O)C(=O)OCC

InChIKey

InChIKey=QYHBUXDMGRSPPN-UHFFFAOYSA-N

Formula

C13H15N3O6

Mass

309.278

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic 1,3-dipolar compounds

Class

Allyl-type 1,3-dipolar organic compounds

Subclass

Organic nitro compounds

Intermediate Tree Nodes

C-nitro compounds

Direct Parent

Nitroaromatic compounds

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Nitroaromatic compound - Aminopyridine - Secondary aliphatic/aromatic amine - Dicarboxylic acid or derivatives - Pyridine - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Organoheterocyclic compound - Allylamine - Propargyl-type 1,3-dipolar organic compound - Azacycle - Carboxylic acid derivative - Secondary amine - Enamine - Organic oxoazanium - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxygen compound - Organic oxide - Organic zwitterion - Carbonyl group - Amine - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitroaromatic compounds. These are c-nitro compounds where the nitro group is C-substituted with an aromatic group.

External Descriptors

Not available

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