Compound Identification
SMILES
COC(=O)C1=CC2=C(C=C1)\C(=C(\NC1=CC=C(C=C1)N(C)C(=O)CN1CCN(C)CC1)C1=CC=CC=C1)C(=O)N2
InChIKey
InChIKey=XZXHXSATPCNXJR-ZIADKAODSA-N
Formula
C31H33N5O4
Mass
539.636
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
Indolecarboxylic acids and derivatives
- Level 5 Indolecarboxylic acids
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Subclass
Indolecarboxylic acids and derivatives
-
Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indolecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Indolecarboxylic acids
Alternative Parents
Alpha amino acids and derivatives N-piperazineacetamides Anilides Indolines Aniline and substituted anilines Secondary alkylarylamines N-methylpiperazines Vinylogous amides Tertiary carboxylic acid amides Methyl esters Trialkylamines Secondary carboxylic acid amides Lactams Monocarboxylic acids and derivatives Azacyclic compounds Enamines Organic oxides Carbonyl compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolecarboxylic acid - Alpha-amino acid or derivatives - N-piperazineacetamide - Dihydroindole - Anilide - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - N-methylpiperazine - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Benzenoid - Methyl ester - Tertiary carboxylic acid amide - Vinylogous amide - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Carboxylic acid ester - Lactam - Amino acid or derivatives - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Enamine - Azacycle - Carboxylic acid derivative - Secondary amine - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Amine - Organic oxide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indolecarboxylic acids. These are compounds containing a carboxylic acid group linked to an indole.
External Descriptors
CHEBI:85164 : methyl ester - aromatic amine - enamine - oxindole - aromatic ester - aromatic amide - N-alkylpiperazine