Compound Identification
SMILES
COC1=CC2=C(C=C1)C(CC(=O)OCC(=O)C1=C(C)N(C(C)=C1)C1=CC(Cl)=C(Cl)C=C1)=CO2
InChIKey
InChIKey=KMZQQQIZXDWIMF-UHFFFAOYSA-N
Formula
C25H21Cl2NO5
Mass
486.35
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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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
Benzofurans Anisoles Aryl alkyl ketones Dichlorobenzenes Alkyl aryl ethers Alpha-acyloxy ketones Aryl chlorides Vinylogous amides Furans Heteroaromatic compounds Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Oxacyclic compounds Organic oxides Organochlorides Organonitrogen compounds Organopnictogen compounds Aldehydes Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrole - Benzofuran - 1,2-dichlorobenzene - Anisole - Aryl ketone - Aryl alkyl ketone - Halobenzene - Alkyl aryl ether - Chlorobenzene - Alpha-acyloxy ketone - Monocyclic benzene moiety - Aryl halide - Benzenoid - Aryl chloride - Furan - Vinylogous amide - Heteroaromatic compound - Ketone - Carboxylic acid ester - Oxacycle - Carboxylic acid derivative - Azacycle - Ether - Monocarboxylic acid or derivatives - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Aldehyde - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Organopnictogen 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