Compound Identification
SMILES
OCC1(CO)C(=O)N(CC2=CC(F)=C(F)C=C2)C2=C(\C=C\C(=O)NS(=O)(=O)C3=CC(F)=C(F)C=C3)C=CC=C12
InChIKey
InChIKey=ZYQOSGKGHXBWHH-WEVVVXLNSA-N
Formula
C26H20F4N2O6S
Mass
564.51
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
Benzenesulfonamides Benzenesulfonyl compounds Indoles and derivatives Styrenes Fluorobenzenes Aryl fluorides Organosulfonic acids and derivatives Aminosulfonyl compounds Tertiary carboxylic acid amides Lactams Amino acids and derivatives Tertiary amines Azacyclic compounds Primary alcohols Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Indole or derivatives - Styrene - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Aminosulfonyl compound - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Amino acid or derivatives - Carboxamide group - Tertiary amine - Lactam - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organosulfur compound - Alcohol - Primary alcohol - Organohalogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - 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