Compound Identification
SMILES
COC1=CC=C(\C=C\C(=O)N2CCN(CC2)C2=NC(=O)C(O2)C2=CC=C(C=C2)C(F)(F)F)C=C1
InChIKey
InChIKey=YUVNDZWAMJSTAA-NYYWCZLTSA-N
Formula
C24H22F3N3O4
Mass
473.452
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 Styrenes Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Piperazines Tertiary carboxylic acid amides Oxazolines Isoureas N-acylimines Propargyl-type 1,3-dipolar organic compounds Carboximidamides Azacyclic compounds Oxacyclic compounds Organofluorides Hydrocarbon derivatives Carbonyl compounds Amines Alkyl fluorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Trifluoromethylbenzene - Phenoxy compound - Anisole - Styrene - Phenol ether - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Piperazine - Benzenoid - 1,4-diazinane - Oxazoline - Tertiary carboxylic acid amide - N-acylimine - Carboxamide group - Isourea - Carboxylic acid derivative - Oxacycle - Azacycle - Ether - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Amine - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - Carbonyl group - 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