Structure Information
Structure

Compound Identification

SMILES

FC1=CC(=C(C=CC(=O)N2CCOC(COC3=CC=C(C=C3)N3C=NC=N3)C2)C=C1)C(F)(F)F

InChIKey

InChIKey=QBMRVILEPTZSMI-UHFFFAOYSA-N

Formula

C23H20F4N4O3

Mass

476.432

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Cinnamic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Cinnamic acid or derivatives - Phenyltriazole - Phenyl-1,2,4-triazole - Trifluoromethylbenzene - Phenoxy compound - Phenol ether - Styrene - Alkyl aryl ether - Halobenzene - Fluorobenzene - Morpholine - Aryl fluoride - Aryl halide - Oxazinane - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Triazole - 1,2,4-triazole - Azole - Heteroaromatic compound - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Dialkyl ether - Ether - Alkyl halide - Alkyl fluoride - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as cinnamic acids and derivatives. These are organic aromatic compounds containing a benzene and a carboxylic acid group (or a derivative thereof) forming 3-phenylprop-2-enoic acid.

External Descriptors

Not available

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