Compound Identification
SMILES
CC1CC(C(OC(=O)C2=C3NC(=NC(=O)N3C=C2C2=CC=C(Cl)C=C2)C2=CC(Cl)=C(Cl)C=C2)C(C1)C(C)(C)C)C(C)(C)C
InChIKey
InChIKey=BZZKIEPJHHOXLM-UHFFFAOYSA-N
Formula
C34H38Cl3N3O3
Mass
643.05
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
-
Subclass
Substituted pyrroles
- Level 5 Phenylpyrroles
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Subclass
Substituted pyrroles
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Class
Pyrroles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroles
Subclass
Substituted pyrroles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrroles
Alternative Parents
Aromatic monoterpenoids Bicyclic monoterpenoids Pyrrolotriazines Pyrrole carboxylic acids and derivatives Dichlorobenzenes Triazinones 1,3,5-triazines Aryl chlorides Vinylogous amides Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyrrole - Aromatic monoterpenoid - Monoterpenoid - Bicyclic monoterpenoid - Pyrrolotriazine - 1,2-dichlorobenzene - Pyrrole-3-carboxylic acid or derivatives - Halobenzene - Chlorobenzene - Triazinone - Aryl chloride - Aryl halide - Triazine - Benzenoid - 1,3,5-triazine - Monocyclic benzene moiety - Heteroaromatic compound - Vinylogous amide - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Aromatic heteropolycyclic 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