Compound Identification
SMILES
FC(F)(F)C1=CC=CC(\C=C\C(=O)N2CCN(CCC(=O)C3=CC4=C(NC(=O)O4)C=C3)CC2)=C1
InChIKey
InChIKey=XXJRJKVUMWUZHD-QPJJXVBHSA-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 Benzoxazolones Aryl alkyl ketones Styrenes N-alkylpiperazines Beta-amino ketones Heteroaromatic compounds Tertiary carboxylic acid amides Oxazoles Trialkylamines Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Organofluorides Organic oxides Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid or derivatives - Benzoxazolone - Trifluoromethylbenzene - Benzoxazole - Styrene - Aryl ketone - Aryl alkyl ketone - N-alkylpiperazine - Monocyclic benzene moiety - Beta-aminoketone - 1,4-diazinane - Piperazine - Benzenoid - Tertiary carboxylic acid amide - Oxazole - Heteroaromatic compound - Azole - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Ketone - Carboxamide group - Organoheterocyclic compound - Azacycle - Oxacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Amine - Carbonyl group - Alkyl halide - Organic oxygen compound - Organic nitrogen compound - Alkyl fluoride - Organohalogen 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