Compound Identification
SMILES
COC1=C(F)C=C2N(CC3=CC=C(SC(F)F)C=C3)C(C)=C(CC(O)=O)C2=C1
InChIKey
InChIKey=WBOPFLYAFDXZNT-UHFFFAOYSA-N
Formula
C20H18F3NO3S
Mass
409.42
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
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Subclass
Indolyl carboxylic acids and derivatives
- Level 5 Indole-3-acetic acid derivatives
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Subclass
Indolyl carboxylic acids and derivatives
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Class
Indoles and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indolyl carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Indole-3-acetic acid derivatives
Alternative Parents
3-alkylindoles N-alkylindoles Thiophenol ethers Anisoles Alkyl aryl ethers Alkylarylthioethers Substituted pyrroles Aryl fluorides Benzene and substituted derivatives Heteroaromatic compounds Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Sulfenyl compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole-3-acetic acid derivative - 3-alkylindole - N-alkylindole - Indole - Phenol ether - Thiophenol ether - Aryl thioether - Anisole - Alkylarylthioether - Alkyl aryl ether - Benzenoid - Substituted pyrrole - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Pyrrole - Heteroaromatic compound - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Sulfenyl compound - Thioether - Monocarboxylic acid or derivatives - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indole-3-acetic acid derivatives. These are compounds containing an acetic acid (or a derivative) linked to the C3 carbon atom of an indole.
External Descriptors
Not available