Compound Identification
SMILES
FC1=C(C=CC(=O)N2CCC(CC2)C2=NC=CN2CC2=CC=CC=N2)C=C(C=C1)C(F)(F)F
InChIKey
InChIKey=XAOZJBHYIZDCHV-UHFFFAOYSA-N
Formula
C24H22F4N4O
Mass
458.461
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
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
Trifluoromethylbenzenes N-acylpiperidines Styrenes Fluorobenzenes Aryl fluorides Pyridines and derivatives N-substituted imidazoles Heteroaromatic compounds Tertiary carboxylic acid amides Azacyclic compounds Alkyl fluorides Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Trifluoromethylbenzene - N-acyl-piperidine - Styrene - Halobenzene - Fluorobenzene - N-substituted imidazole - Aryl fluoride - Aryl halide - Piperidine - Monocyclic benzene moiety - Benzenoid - Pyridine - Tertiary carboxylic acid amide - Imidazole - Azole - Heteroaromatic compound - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organofluoride - Organonitrogen compound - Organooxygen compound - Alkyl fluoride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - 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