Compound Identification
SMILES
COC1=C(F)C=C2N(C(=O)C3=CC=C(OC(F)(F)F)S3)C(C)=C(CC(O)=O)C2=C1
InChIKey
InChIKey=JDFBYVIFLGIBAZ-UHFFFAOYSA-N
Formula
C18H13F4NO5S
Mass
431.36
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
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
-
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
Indolecarboxylic acids and derivatives 3-alkylindoles Thiophene carboxamides Anisoles 2,5-disubstituted thiophenes Alkyl aryl ethers Substituted pyrroles Aryl fluorides Heteroaromatic compounds Trihalomethanes Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Alkyl fluorides Organofluorides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole-3-acetic acid derivative - Indolecarboxylic acid derivative - 3-alkylindole - Indole - Anisole - Phenol ether - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Alkyl aryl ether - 2,5-disubstituted thiophene - Aryl fluoride - Substituted pyrrole - Aryl halide - Benzenoid - Pyrrole - Heteroaromatic compound - Thiophene - Trihalomethane - Carboxylic acid derivative - Carboxylic acid - Ether - Azacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Hydrocarbon derivative - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Carbonyl group - Halomethane - Organic oxide - Organooxygen compound - Organohalogen compound - Organofluoride - Organonitrogen 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