Structure Information
Structure

Compound Identification

SMILES

CC1=CC2=C(O)C(CC3=CC(CC(O)=O)=CC(CC4=CC(C)=CC(CC5=C(O)C(C2)=CC(=C5)[N+]([O-])=O)=C4O)=C3O)=C1

InChIKey

InChIKey=XJMIRQCTJVJALK-UHFFFAOYSA-N

Formula

C32H29NO8

Mass

555.583

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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 homopolycyclic compounds

Substituents

Nitroaromatic compound - Phenol - Benzenoid - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxoazanium - Polyol - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organic salt - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic homopolycyclic 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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