Structure Information
Structure

Compound Identification

SMILES

O[N+]([O-])=O.O[N+]([O-])=O.COC(C([Tl])C(=O)C1=C(OC)C=C(OC)C=C1OC)C1=CC=CC=C1

InChIKey

InChIKey=QRRNWVUADYXGBC-UHFFFAOYSA-N

Formula

C19H23N2O11Tl

Mass

659.78

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Linear 1,3-diarylpropanoids

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Linear 1,3-diarylpropanoids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Linear 1,3-diarylpropanoid - Alkyl-phenylketone - Butyrophenone - Benzylether - Phenylketone - Anisole - Benzoyl - Phenoxy compound - Phenol ether - Aryl ketone - Aryl alkyl ketone - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Organic nitrate - Organic nitro compound - Ketone - Organic nitric acid - Organic nitric acid or derivatives - Organic 1,3-dipolar compound - Ether - Dialkyl ether - Allyl-type 1,3-dipolar organic compound - Organometallic compound - Organic post-transition metal moeity - Organic oxide - Hydrocarbon derivative - Organothalium compound - Organic nitrogen compound - Organic salt - Organooxygen compound - Organic oxygen compound - Organic zwitterion - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as linear 1,3-diarylpropanoids. These are organic compounds with a structure based on a C6-C3-C6 skeleton, where the two benzene rings are not linked together.

External Descriptors

Not available

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