Compound Identification
SMILES
OCCN1CC(=O)N2C(CC3=C(NC4=CC=CC=C34)C2C2=CC=C(Cl)C=C2)C1=O
InChIKey
InChIKey=IYZOBDABGSEJFT-UHFFFAOYSA-N
Formula
C22H20ClN3O3
Mass
409.87
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
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Subclass
Pyridoindoles
- Level 5 Beta carbolines
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Subclass
Pyridoindoles
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Pyridoindoles
Intermediate Tree Nodes
Not available
Direct Parent
Beta carbolines
Alternative Parents
3-alkylindoles Alpha amino acids and derivatives 2,5-dioxopiperazines Chlorobenzenes N-alkylpiperazines Aryl chlorides Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Lactams Azacyclic compounds Alkanolamines Organic oxides Carbonyl compounds Organochlorides Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta-carboline - Alpha-amino acid or derivatives - 3-alkylindole - Indole - Dioxopiperazine - 2,5-dioxopiperazine - Halobenzene - Chlorobenzene - N-alkylpiperazine - 1,4-diazinane - Monocyclic benzene moiety - Piperazine - Aryl halide - Aryl chloride - Benzenoid - Tertiary carboxylic acid amide - Pyrrole - Heteroaromatic compound - Carboxamide group - Lactam - Carboxylic acid derivative - Alkanolamine - Azacycle - Alcohol - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as beta carbolines. These are compounds containing a 9H-pyrido[3,4-b]indole moiety.
External Descriptors
Not available