Compound Identification
SMILES
CC(CCCC(O)=O)N1CC2(C)OC(C)(C1)C1=C(O)N(C(O)=C21)C1=CC(=C(C=C1)C#N)C(F)(F)F
InChIKey
InChIKey=BAUMVIMKHSBLIF-UHFFFAOYSA-N
Formula
C24H26F3N3O5
Mass
493.483
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
Trifluoromethylbenzenes Benzonitriles Medium-chain fatty acids Aralkylamines Azepines Halogenated fatty acids Heterocyclic fatty acids Hydroxy fatty acids Morpholines Heteroaromatic compounds Amino acids Trialkylamines Oxacyclic compounds Azacyclic compounds Dialkyl ethers Carboxylic acids Monocarboxylic acids and derivatives Nitriles Hydrocarbon derivatives Alkyl fluorides Carbonyl compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrole - Trifluoromethylbenzene - Medium-chain fatty acid - Benzonitrile - Halogenated fatty acid - Heterocyclic fatty acid - Hydroxy fatty acid - Aralkylamine - Azepine - Oxazinane - Fatty acyl - Fatty acid - Benzenoid - Morpholine - Monocyclic benzene moiety - Heteroaromatic compound - Amino acid - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Hydrocarbon derivative - Organic nitrogen compound - Amine - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Cyanide - Organooxygen compound - Organic oxide - Carbonyl group - Organohalogen compound - Organofluoride - Organonitrogen 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