Compound Identification
SMILES
COC1=CC=C(C=C1)C(C)N1C(C)=C2C3=CC(=CN3N=C(C)C2=C1C)C1=CC=C(Br)C=C1
InChIKey
InChIKey=RMRYKJVFUPAESQ-UHFFFAOYSA-N
Formula
C27H26BrN3O
Mass
488.429
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
Pyrrolo[3,4-d]pyridazines Phenoxy compounds Methoxybenzenes Anisoles Bromobenzenes Alkyl aryl ethers Pyridazines and derivatives Aryl bromides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyrrole - Pyrrolo[3,4-d]pyridazine - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Halobenzene - Pyridazine - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Benzenoid - Heteroaromatic compound - Ether - Azacycle - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen 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