Compound Identification
SMILES
CC(=O)N1C[C@H]2CC(C3=CC=C(CCCOC4=C(F)C=CC(F)=C4F)C=C3)=C([C@@H](C1)N2)C(=O)N(CC1=CC(F)=CC(F)=C1)C1CC1
InChIKey
InChIKey=KNSARYZDVQPQFX-MXBOTTGLSA-N
Formula
C35H34F5N3O3
Mass
639.667
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
Phenoxy compounds Phenol ethers Fluorobenzenes Alkyl aryl ethers Piperazines Aryl fluorides Tertiary carboxylic acid amides Acetamides Amino acids and derivatives Dialkylamines Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid or derivatives - Phenoxy compound - Phenol ether - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Benzenoid - Piperazine - Acetamide - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid derivative - Azacycle - Secondary amine - Ether - Organoheterocyclic compound - Secondary aliphatic amine - Organonitrogen compound - Organooxygen compound - Organohalogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organofluoride - Aromatic heteropolycyclic 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