Compound Identification
SMILES
COC(=O)C1=C(N=C2N=CNN2[C@@H]1C1=CC=C(Cl)C=C1)C1=CC=CC=C1
InChIKey
InChIKey=BUFYSRXMCINPCT-QGZVFWFLSA-N
Formula
C19H15ClN4O2
Mass
366.81
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 Chlorobenzenes Aryl chlorides Hydropyrimidines Methyl esters Enoate esters Triazolines Amidrazones Monocarboxylic acids and derivatives Formamidines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Imines Hydrocarbon derivatives Carbonyl compounds Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid ester - Triazolopyrimidine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - 1,6-dihydropyrimidine - Benzenoid - Triazoline - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Carboxylic acid amidrazone - Carboxylic acid ester - Amidine - Formamidine - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Imine - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - 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