Compound Identification
SMILES
CCOC(=O)C1=C(SC(S1)=C1C(=S)C(C)(C)N(C(=O)C(F)(F)F)C2=C1C=C(OCC)C=C2)C1=CC=CC=C1
InChIKey
InChIKey=KEGIEDFVQMECPD-UHFFFAOYSA-N
Formula
C27H24F3NO4S3
Mass
579.67
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acid esters
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Class
Cinnamic acids and derivatives
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Cinnamic acids and derivatives
Subclass
Cinnamic acid esters
Intermediate Tree Nodes
Not available
Direct Parent
Cinnamic acid esters
Alternative Parents
Hydroquinolines Phenol ethers Alkyl aryl ethers Vinylogous thioesters Benzene and substituted derivatives 1,3-dithioles Tertiary carboxylic acid amides Enoate esters Thioketones Thioenol ethers Ketene acetals Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organofluorides Carbonyl compounds Organonitrogen compounds Organic oxides Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid ester - Tetrahydroquinoline - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Vinylogous thioester - Benzenoid - Tertiary carboxylic acid amide - 1,3-dithiole - Dithiole - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxamide group - Thioketone - Thioenolether - Carboxylic acid ester - Ketene acetal or derivatives - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Organohalogen compound - Alkyl fluoride - Organic nitrogen compound - Organic oxide - Alkyl halide - Thiocarbonyl group - Organic oxygen compound - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic acid.
External Descriptors
Not available