Compound Identification
SMILES
CCCCC1=NC(CO)=C(Cl)N1CC1=CC=C(C=C1)N1C=CC(Cl)=C1C(=O)OC
InChIKey
InChIKey=BHBJULKNFDNPNK-UHFFFAOYSA-N
Formula
C21H23Cl2N3O3
Mass
436.33
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
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Subclass
Substituted pyrroles
- Level 5 Phenylpyrroles
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Subclass
Substituted pyrroles
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Class
Pyrroles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroles
Subclass
Substituted pyrroles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrroles
Alternative Parents
1,2,4,5-tetrasubstituted imidazoles Pyrrole carboxylic acids and derivatives Imidazolyl carboxylic acids and derivatives Aryl chlorides Benzene and substituted derivatives N-substituted imidazoles Vinylogous halides Heteroaromatic compounds Methyl esters Azacyclic compounds Hydrocarbon derivatives Aromatic alcohols Organonitrogen compounds Organochlorides Primary alcohols Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrole - 1,2,4,5-tetrasubstituted imidazole - Pyrrole-2-carboxylic acid or derivatives - Imidazolyl carboxylic acid derivative - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Azole - Heteroaromatic compound - Vinylogous halide - Methyl ester - Imidazole - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Organooxygen compound - Primary alcohol - Aromatic alcohol - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organochloride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrroles. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrole ring through a CC or CN bond.
External Descriptors
Not available