Compound Identification
SMILES
[O-][N+](=O)C1=CC(Br)=C(NC(=O)COC(=O)C=CC2=CC=C(OC(F)F)C=C2)C=C1
InChIKey
InChIKey=MAJFPQILBXNJOC-UHFFFAOYSA-N
Formula
C18H13BrF2N2O6
Mass
471.211
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
Anilides Nitrobenzenes Styrenes Phenoxy compounds Phenol ethers N-arylamides Nitroaromatic compounds Bromobenzenes Fatty acid esters Aryl bromides Enoate esters Secondary carboxylic acid amides Organic oxoazanium compounds Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Organic oxides Organic salts Hydrocarbon derivatives Organobromides Alkyl fluorides Carbonyl compounds Organofluorides Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamic acid ester - Nitrobenzene - Anilide - Phenoxy compound - Nitroaromatic compound - Phenol ether - Styrene - N-arylamide - Bromobenzene - Fatty acid ester - Halobenzene - Monocyclic benzene moiety - Aryl halide - Benzenoid - Aryl bromide - Fatty acyl - Alpha,beta-unsaturated carboxylic ester - Enoate ester - C-nitro compound - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Organic nitro compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Monocarboxylic acid or derivatives - Organic salt - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Alkyl halide - Organobromide - Organofluoride - Organonitrogen compound - Carbonyl group - Alkyl fluoride - Organooxygen compound - Organic oxygen compound - Organic oxide - Organic cation - Aromatic homomonocyclic 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