Compound Identification
SMILES
CCOC1=CC=CC=C1C1=C(CC(O)=O)C2=C(N1)C=CC(I)=C2
InChIKey
InChIKey=MFSBZPLFVWAWCT-UHFFFAOYSA-N
Formula
C18H16INO3
Mass
421.234
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
-
Subclass
Substituted pyrroles
- Level 5 Phenylpyrroles
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Subclass
Substituted pyrroles
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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
Indoles Phenoxy compounds Phenol ethers Heterocyclic fatty acids Halogenated fatty acids Branched fatty acids Alkyl aryl ethers Heteroaromatic compounds Amino acids Vinyl iodides Monocarboxylic acids and derivatives Iodoalkenes Dialkylamines Carboxylic acids Azacyclic compounds Organopnictogen compounds Organoiodides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrole - Indole or derivatives - Indole - Phenoxy compound - Phenol ether - Heterocyclic fatty acid - Halogenated fatty acid - Branched fatty acid - Alkyl aryl ether - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Amino acid - Amino acid or derivatives - Azacycle - Iodoalkene - Haloalkene - Vinyl iodide - Vinyl halide - Secondary amine - Monocarboxylic acid or derivatives - Ether - Secondary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organoiodide - Organohalogen compound - Amine - 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