Compound Identification
SMILES
CCOC1=CC=C(C=C1)C(=O)CC(C(O)=O)C1=CN(C)C2=CC=CC=C12
InChIKey
InChIKey=MQKJFUNACPJMRQ-UHFFFAOYSA-N
Formula
C21H21NO4
Mass
351.402
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
-
Subclass
Indolyl carboxylic acids and derivatives
- Level 5 Indole-3-acetic acid derivatives
-
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
Alkyl-phenylketones Butyrophenones 3-alkylindoles N-alkylindoles Phenoxy compounds Phenol ethers Aryl alkyl ketones Benzoyl derivatives Gamma-keto acids and derivatives Alkyl aryl ethers N-methylpyrroles Heteroaromatic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Organonitrogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole-3-acetic acid derivative - Alkyl-phenylketone - Butyrophenone - 3-alkylindole - N-alkylindole - Indole - Phenylketone - Phenoxy compound - Phenol ether - Aryl ketone - Aryl alkyl ketone - Gamma-keto acid - Benzoyl - Alkyl aryl ether - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - N-methylpyrrole - Keto acid - Pyrrole - Heteroaromatic compound - Ketone - Carboxylic acid derivative - Carboxylic acid - Ether - Azacycle - Monocarboxylic acid or derivatives - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - 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