Compound Identification
SMILES
OC(=O)\C=C/C([O-])=O.CC(C1=CN(CC2=CC=C(Cl)C=C2)C2=CC=CC=C12)[N+]1=CNC=C1
InChIKey
InChIKey=GPYHQSUNAJISAC-BTJKTKAUSA-N
Formula
C24H22ClN3O4
Mass
451.91
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
- Subclass N-alkylindoles
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
N-alkylindoles
Intermediate Tree Nodes
Not available
Direct Parent
N-alkylindoles
Alternative Parents
3-alkylindoles Chlorobenzenes Unsaturated fatty acids Substituted pyrroles Aryl chlorides Dicarboxylic acids and derivatives N-substituted imidazoles Heteroaromatic compounds Carboxylic acid salts Carboxylic acids Azacyclic compounds Organic oxides Organonitrogen compounds Carbonyl compounds Organochlorides Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
3-alkylindole - N-alkylindole - Indole - Halobenzene - Chlorobenzene - N-substituted imidazole - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Substituted pyrrole - Fatty acyl - Fatty acid - Benzenoid - Monocyclic benzene moiety - Unsaturated fatty acid - Pyrrole - Azole - Imidazole - Heteroaromatic compound - Carboxylic acid salt - Carboxylic acid derivative - Azacycle - Carboxylic acid - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 1-position.
External Descriptors
Not available