Compound Identification
SMILES
CCOC(=O)C1=C(N=C2S\C(=C\C3=C(C)N(C(C)=C3)C3=CC(F)=C(Cl)C=C3)C(=O)N2[C@H]1C1=CC2=C(OCO2)C=C1)C1=CC=CC=C1
InChIKey
InChIKey=TWZULRLTBGOYKM-SLDXWZKBSA-N
Formula
C35H27ClFN3O5S
Mass
656.13
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Cinnamic acids and derivatives
- Subclass Cinnamic acid esters
-
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
Phenylpyrroles Benzodioxoles Chlorobenzenes Fluorobenzenes Aryl chlorides Aryl fluorides Thiazoles Heteroaromatic compounds Enoate esters Lactams Isothioureas Oxacyclic compounds Acetals Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organofluorides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cinnamic acid ester - 1-phenylpyrrole - Benzodioxole - Halobenzene - Fluorobenzene - Chlorobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Substituted pyrrole - Azole - Heteroaromatic compound - Pyrrole - Enoate ester - Thiazole - Alpha,beta-unsaturated carboxylic ester - Isothiourea - Carboxylic acid ester - Lactam - Acetal - Oxacycle - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organochloride - Organic oxide - Organohalogen compound - 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