Compound Identification
SMILES
[O-][N+](=O)C1=C(Cl)C=CC(\C=C\C(=O)OCC2=COC(=N2)C2=CC=C(F)C=C2)=C1
InChIKey
InChIKey=BPQOHEKIZROJFK-KRXBUXKQSA-N
Formula
C19H12ClFN2O5
Mass
402.76
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
Phenyl-1,3-oxazoles Nitrobenzenes Styrenes Nitroaromatic compounds 2,4-disubstituted oxazoles Chlorobenzenes Fatty acid esters Fluorobenzenes Aryl chlorides Aryl fluorides Enoate esters Heteroaromatic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrocarbon derivatives Organic salts Organochlorides Organofluorides Carbonyl compounds Organonitrogen compounds Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid ester - Phenyl-1,3-oxazole - Nitrobenzene - Nitroaromatic compound - Styrene - 2,4-disubstituted 1,3-oxazole - Chlorobenzene - Fatty acid ester - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Azole - Heteroaromatic compound - Oxazole - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organic salt - Organohalogen compound - Organic oxide - Organochloride - Organofluoride - Organonitrogen compound - Organic cation - Aromatic heteromonocyclic 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