Compound Identification
SMILES
CC12N(CC(C3=C1NC1=CC=CC=C31)C1=CC=C(Cl)C=C1)C(=O)CN(CC1=C(F)C=CC=C1Cl)C2=O
InChIKey
InChIKey=CPNJBDPBBDENNU-UHFFFAOYSA-N
Formula
C28H22Cl2FN3O2
Mass
522.4
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
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 Fluorobenzenes Aryl chlorides Aryl fluorides Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Lactams Azacyclic compounds Organic oxides Carbonyl compounds Organochlorides Organofluorides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta-carboline - Alpha-amino acid or derivatives - 3-alkylindole - Indole - Dioxopiperazine - 2,5-dioxopiperazine - Halobenzene - Fluorobenzene - Chlorobenzene - N-alkylpiperazine - Piperazine - Aryl halide - Aryl chloride - 1,4-diazinane - Aryl fluoride - Benzenoid - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Pyrrole - Heteroaromatic compound - Carboxamide group - Lactam - Carboxylic acid derivative - Azacycle - Organochloride - Organofluoride - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen 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