Compound Identification
SMILES
O=C(NC1=CC=CC=C1)C(C(=O)\C=C\C1=CC2=C(OCCO2)C=C1)=C1SCCS1
InChIKey
InChIKey=CBHGJOLXOKVSJI-SOFGYWHQSA-N
Formula
C22H19NO4S2
Mass
425.52
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
Benzo-1,4-dioxanes Anilides Styrenes N-arylamides Alkyl aryl ethers Vinylogous thioesters Para dioxins Fatty amides 1,3-dithiolanes Acryloyl compounds Enones Secondary carboxylic acid amides Ketones Ketene acetals Oxacyclic compounds Organic oxides Organopnictogen compounds Aldehydes Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid or derivatives - Benzo-1,4-dioxane - Benzodioxane - Anilide - Styrene - N-arylamide - Alkyl aryl ether - Fatty amide - Monocyclic benzene moiety - Para-dioxin - Vinylogous thioester - Fatty acyl - Benzenoid - Acryloyl-group - Enone - Dithiolane - Alpha,beta-unsaturated ketone - 1,3-dithiolane - Carboxamide group - Secondary carboxylic acid amide - Ketene acetal or derivatives - Ketone - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Aldehyde - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic 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