Compound Identification
SMILES
CC1=CC=C(C=C1)N1C2=C3C(=CC=CC3=C(Cl)C=C2)C1=C1C(=O)OC(C)(C)OC1=O
InChIKey
InChIKey=BKODWAHRYAABEW-UHFFFAOYSA-N
Formula
C24H18ClNO4
Mass
419.86
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
-
Subclass
Substituted pyrroles
- Level 5 Phenylpyrroles
-
Subclass
Substituted pyrroles
-
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
Chloronaphthalenes Indoles Isoindoles Toluenes Ketals 1,3-dioxanes Aryl chlorides Dicarboxylic acids and derivatives Heteroaromatic compounds Enoate esters Vinylogous amides Lactones Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chloronaphthalene - 1-phenylpyrrole - Naphthalene - Isoindole or derivatives - Isoindole - Indole or derivatives - Indole - Ketal - Toluene - Meta-dioxane - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Heteroaromatic compound - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Lactone - Carboxylic acid ester - Acetal - Carboxylic acid derivative - Oxacycle - Azacycle - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - 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