Compound Identification
SMILES
[B]C1=CC(C)=C(N2C=C(C)C3=C2N=C(C)N=C3N2CCC(COP(O)(O)=O)CC2)C(C)=C1
InChIKey
InChIKey=MCECIDIJJHBPAS-UHFFFAOYSA-N
Formula
C22H28BN4O4P
Mass
454.27
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[2,3-d]pyrimidines m-Xylenes Dialkylarylamines Monoalkyl phosphates Aminopyrimidines and derivatives Piperidines Imidolactams Heteroaromatic compounds Organic metalloid salts Azacyclic compounds Organooxygen compounds Organometalloid compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrole - Pyrrolopyrimidine - Pyrrolo[2,3-d]pyrimidine - M-xylene - Xylene - Dialkylarylamine - Aminopyrimidine - Monoalkyl phosphate - Phosphoric acid ester - Piperidine - Pyrimidine - Imidolactam - Benzenoid - Organic phosphoric acid derivative - Alkyl phosphate - Monocyclic benzene moiety - Heteroaromatic compound - Organic metalloid salt - Azacycle - Amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic metalloid moeity - Organic oxygen 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