Compound Identification
SMILES
COC1=CC=C(C=C1)N1C(C)=CC(C(=O)COC(=O)C2=CC(O)=CC=C2)=C1C
InChIKey
InChIKey=SFBMIIHHZBEBNC-UHFFFAOYSA-N
Formula
C22H21NO5
Mass
379.412
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
m-Hydroxybenzoic acid esters Methoxyanilines Phenoxy compounds Methoxybenzenes Anisoles Aryl alkyl ketones Benzoyl derivatives 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Vinylogous amides Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrole - M-hydroxybenzoic acid ester - Benzoate ester - Methoxyaniline - Benzoic acid or derivatives - Benzoyl - Phenol ether - Aryl ketone - Aryl alkyl ketone - Phenoxy compound - Methoxybenzene - Anisole - Phenol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Vinylogous amide - Heteroaromatic compound - Carboxylic acid ester - Ketone - Ether - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen 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