Compound Identification
SMILES
COC1=CC=CC=C1\C=C\C(=O)C1=C(C)NC(S1)=C1C=CC(=O)C=C1
InChIKey
InChIKey=YLAVRUOVRMXWAV-FMIVXFBMSA-N
Formula
C20H17NO3S
Mass
351.42
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
Anisoles Methoxybenzenes P-quinomethanes Phenoxy compounds Styrenes Alkyl aryl ethers Acryloyl compounds Enones Thiazolines Vinylogous amides Ketene acetals Thioenol ethers Azacyclic compounds Enamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Cinnamic acid or derivatives - Phenoxy compound - Anisole - P-quinomethane - Methoxybenzene - Phenol ether - Quinomethane - Styrene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Acryloyl-group - Enone - Vinylogous amide - Alpha,beta-unsaturated ketone - Meta-thiazoline - Cyclic ketone - Thioenolether - Ketene acetal or derivatives - Ketone - Organoheterocyclic compound - Azacycle - Enamine - Ether - Hydrocarbon derivative - Carbonyl group - Organic oxide - Amine - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - 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