Compound Identification
SMILES
CCOC1=C2OCCOC2=C(SC2=C(Cl)C=C(\C=C\C(=O)N3CCN(CC3)C(C)=O)C=C2)C=C1
InChIKey
InChIKey=BIKPGEZVXZVOOJ-WEVVVXLNSA-N
Formula
C25H27ClN2O5S
Mass
503.01
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
Diarylthioethers Benzo-1,4-dioxanes Thiophenol ethers Styrenes Phenol ethers Alkyl aryl ethers Chlorobenzenes Piperazines Para dioxins Aryl chlorides Tertiary carboxylic acid amides Acetamides Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid or derivatives - Diarylthioether - Benzodioxane - Benzo-1,4-dioxane - Phenol ether - Styrene - Thiophenol ether - Aryl thioether - Halobenzene - Chlorobenzene - Alkyl aryl ether - Benzenoid - Para-dioxin - 1,4-diazinane - Piperazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Acetamide - Carboxamide group - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Sulfenyl compound - Thioether - Ether - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organohalogen compound - Organochloride - 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