Compound Identification
SMILES
CCOC(=O)C1=NOC(=C1)C(=O)C1=C(CC(O)=O)C2=C(N1)C=CC(Cl)=C2
InChIKey
InChIKey=PMPUQEAJZNFAHQ-UHFFFAOYSA-N
Formula
C17H13ClN2O6
Mass
376.75
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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
-
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 Aryl ketones Substituted pyrroles Aryl chlorides Benzenoids Dicarboxylic acids and derivatives Isoxazoles Heteroaromatic compounds Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Carboxylic acids Organochlorides Aldehydes Organonitrogen compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole-3-acetic acid derivative - Indolecarboxylic acid derivative - 3-alkylindole - Indole - Aryl ketone - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Benzenoid - Substituted pyrrole - Azole - Heteroaromatic compound - Pyrrole - Isoxazole - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Azacycle - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aldehyde - Carbonyl group - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen 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