Compound Identification
SMILES
CCOC(=O)C1=C(C)C2=C(C=C1C)N(CCN1CCN(CC1)C(=O)\C=C\C1=CC=CC=C1)C(=O)N(C2=O)C1=CC=CC=C1C(F)(F)F
InChIKey
InChIKey=ZJKXCJGAMTVXTA-CCEZHUSRSA-N
Formula
C35H35F3N4O5
Mass
648.683
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 Quinazolines Styrenes N-alkylpiperazines Pyrimidones Vinylogous amides Heteroaromatic compounds Tertiary carboxylic acid amides Amino acids and derivatives Carboxylic acid esters Ureas Lactams Trialkylamines Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid or derivatives - Trifluoromethylbenzene - Quinazoline - Styrene - Pyrimidone - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Pyrimidine - Benzenoid - Tertiary carboxylic acid amide - Vinylogous amide - Heteroaromatic compound - Urea - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Lactam - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Hydrocarbon derivative - Organohalogen compound - Alkyl halide - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Alkyl fluoride - Amine - Organic oxygen compound - Organic oxide - 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