Compound Identification
SMILES
CCOC(=O)C1=C(N=C2N=CNN2[C@H]1C1=CC=C(OCC2=C(F)C=CC=C2Cl)C=C1)C1=CC=CC=C1
InChIKey
InChIKey=LZYAWOBCZVMDFH-VWLOTQADSA-N
Formula
C27H22ClFN4O3
Mass
504.95
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acid esters
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Class
Cinnamic acids and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Cinnamic acid esters
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acid esters
Alternative Parents
Triazolopyrimidines Phenoxy compounds Phenol ethers Alkyl aryl ethers Fluorobenzenes Chlorobenzenes Aryl chlorides Aryl fluorides Hydropyrimidines Triazolines Enoate esters Amidrazones Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Azacyclic compounds Formamidines Carbonyl compounds Hydrocarbon derivatives Imines Organic oxides Organochlorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid ester - Triazolopyrimidine - Phenol ether - Phenoxy compound - Halobenzene - Alkyl aryl ether - Fluorobenzene - Chlorobenzene - Hydropyrimidine - 1,6-dihydropyrimidine - Benzenoid - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Triazoline - Carboxylic acid ester - Carboxylic acid amidrazone - Amidine - Formamidine - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Imine - Carbonyl group - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic acid.
External Descriptors
Not available