Compound Identification
SMILES
[O-]C1=C(C(=O)C=CC2=CC=C(C=C2)C(F)(F)F)[N+](=NO1)C1=CC=CC=C1
InChIKey
InChIKey=DDNPZBPYIXQWJA-UHFFFAOYSA-N
Formula
C18H11F3N2O3
Mass
360.292
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acids and derivatives
Alternative Parents
Trifluoromethylbenzenes Styrenes Aryl ketones Vinylogous acids 1,2,3-oxadiazoles Acryloyl compounds Enones Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Alkyl fluorides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Trifluoromethylbenzene - Styrene - Aryl ketone - Monocyclic benzene moiety - Benzenoid - Acryloyl-group - Azole - Enone - Oxadiazole - 1,2,3-oxadiazole - Heteroaromatic compound - Alpha,beta-unsaturated ketone - Vinylogous acid - Ketone - Oxacycle - Azacycle - Organoheterocyclic compound - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic salt - Alkyl halide - Organic oxide - Alkyl fluoride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acids and derivatives. These are organic aromatic compounds containing a benzene and a carboxylic acid group (or a derivative thereof) forming 3-phenylprop-2-enoic acid.
External Descriptors
Not available