Compound Identification
SMILES
ONC(=O)C1=CC=C(\C=C\C(=O)N2CCC(CN[I]3C[C@@H]3C3=CC=C(F)C=C3)CC2)C=C1
InChIKey
InChIKey=VTHHLQSLADBUOG-DMSSFVEISA-N
Formula
C24H27FIN3O3
Mass
551.401
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
N-acylpiperidines Benzoic acids and derivatives Styrenes Benzoyl derivatives Fluorobenzenes Aryl fluorides Tertiary carboxylic acid amides Hydroxamic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl iodides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - N-acyl-piperidine - Benzoic acid or derivatives - Styrene - Benzoyl - Halobenzene - Fluorobenzene - Benzenoid - Piperidine - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Tertiary carboxylic acid amide - Hydroxamic acid - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Carbonyl group - Alkyl iodide - Alkyl halide - 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