Compound Identification
SMILES
COC(=O)C1=C(NC(=S)NC1C1=CC2=C(OCO2)C=C1Cl)C1=CC=C(F)C=C1
InChIKey
InChIKey=VOXLAZCFXYMTDV-UHFFFAOYSA-N
Formula
C19H14ClFN2O4S
Mass
420.84
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acid esters
-
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
Benzodioxoles Hydropyrimidine carboxylic acids and derivatives 2-Thiopyrimidines Pyrimidinethiones Fluorobenzenes Aryl chlorides Aryl fluorides Vinylogous amides Enoate esters Methyl esters Thioureas Acetals Azacyclic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Organofluorides Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organopnictogen compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid ester - Benzodioxole - Hydropyrimidine carboxylic acid derivative - 2-thiopyrimidine - Thiopyrimidine - Fluorobenzene - Halobenzene - Pyrimidinethione - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - Benzenoid - 1,2,3,4-tetrahydropyrimidine - Pyrimidine - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Thiourea - Carboxylic acid ester - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Acetal - Monocarboxylic acid or derivatives - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organopnictogen compound - Organic oxide - Organohalogen compound - Organochloride - Organofluoride - 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