Compound Identification
SMILES
COC(=O)CC1=C(NC2=CC=CC=C12)\C=C\C(C)(C)N1C=NC(CCN2C(=O)CCC2=O)=C1
InChIKey
InChIKey=FYPKQWGFZJIQRS-ZRDIBKRKSA-N
Formula
C25H28N4O4
Mass
448.523
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 Imidazolyl carboxylic acids and derivatives Substituted pyrroles Pyrrolidine-2-ones Benzenoids N-substituted imidazoles N-substituted carboxylic acid imides N-alkylpyrrolidines Dicarboximides Heteroaromatic compounds Methyl esters Lactams Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Organopnictogen compounds Carbonyl compounds Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole-3-acetic acid derivative - 3-alkylindole - Indole - Imidazolyl carboxylic acid derivative - Carboxylic acid imide, n-substituted - N-substituted imidazole - Pyrrolidone - 2-pyrrolidone - Substituted pyrrole - N-alkylpyrrolidine - Benzenoid - Heteroaromatic compound - Dicarboximide - Carboxylic acid imide - Pyrrolidine - Pyrrole - Methyl ester - Imidazole - Azole - Carboxylic acid ester - Lactam - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organopnictogen compound - Organic oxide - 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