Compound Identification
SMILES
CCCCCC(=O)N1C=C(C(N2CCOCC2)=C1C(=O)OC)C1=CC=C(Br)C=C1
InChIKey
InChIKey=WVQKFIFXWCOUBV-UHFFFAOYSA-N
Formula
C22H27BrN2O4
Mass
463.372
Taxonomic Classification
Taxonomy Tree
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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
Pyrrole carboxylic acids and derivatives Dialkylarylamines Bromobenzenes Aryl bromides Morpholines Vinylogous amides Heteroaromatic compounds Methyl esters Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Dialkyl ethers Monocarboxylic acids and derivatives Organopnictogen compounds Organic oxides Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-phenylpyrrole - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Pyrrole-2-carboxylic acid or derivatives - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Morpholine - Oxazinane - Benzenoid - Heteroaromatic compound - Vinylogous amide - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Tertiary amine - Azacycle - Carboxylic acid derivative - Dialkyl ether - Oxacycle - Monocarboxylic acid or derivatives - Ether - Organonitrogen compound - Hydrocarbon derivative - Organohalogen compound - Amine - Organobromide - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - 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