Compound Identification
SMILES
BrC(C(Br)C1=CC=CC=C1)C(=O)C=CC1=CC=CC=C1
InChIKey
InChIKey=QWRCGOMWOXYYBU-UHFFFAOYSA-N
Formula
C17H14Br2O
Mass
394.106
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
Styrenes Enones Alpha-haloketones Acryloyl compounds Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Cinnamic acid or derivatives - Styrene - Monocyclic benzene moiety - Benzenoid - Alpha,beta-unsaturated ketone - Enone - Alpha-haloketone - Acryloyl-group - Ketone - Alkyl bromide - Organic oxygen compound - Organooxygen compound - Organobromide - Organohalogen compound - Carbonyl group - Alkyl halide - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic 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