Compound Identification
SMILES
[Cl-].[Cl-].[Ti+4].CC(=O)\C=C(\[O-])C1=CC=CC=C1.CC(=O)\C=C(\[O-])C1=CC=CC=C1
InChIKey
InChIKey=YLQPQLYVHPRJKH-FHPZIRFBSA-J
Formula
C20H18Cl2O4Ti
Mass
441.13
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 Vinylogous acids Enones Acryloyl compounds Ketones Organic transition metal salts Organic metal halides Organic oxides Organic chloride salts Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
Cinnamic acid or derivatives - Styrene - Monocyclic benzene moiety - Benzenoid - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Vinylogous acid - Ketone - Organic metal halide - Organic transition metal salt - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic salt - Carbonyl group - Organic chloride salt - Organic cation - 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