Compound Identification
SMILES
CC1(COC(OC1)C1=NC(=C(N1)C1=NC(NCCC(O)=O)=NC=C1)C1=CC=C(F)C=C1)C(=O)N1CCC(O)C1
InChIKey
InChIKey=REOXYYGESKJCCB-UHFFFAOYSA-N
Formula
C26H29FN6O6
Mass
540.552
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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Subclass
Imidazoles
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Level 5
Substituted imidazoles
- Level 6 Phenylimidazoles
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Level 5
Substituted imidazoles
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Subclass
Imidazoles
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Class
Azoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Imidazoles
Intermediate Tree Nodes
Substituted imidazoles
Direct Parent
Phenylimidazoles
Alternative Parents
Beta amino acids and derivatives Imidazolyl carboxylic acids and derivatives 2,4,5-trisubstituted imidazoles N-acylpyrrolidines Secondary alkylarylamines Fluorobenzenes Aminopyrimidines and derivatives Aryl fluorides 1,3-dioxanes Tertiary carboxylic acid amides Heteroaromatic compounds Secondary alcohols Oxacyclic compounds Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Acetals Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - 5-phenylimidazole - 4-phenylimidazole - 2,4,5-trisubstituted-imidazole - Imidazolyl carboxylic acid derivative - N-acylpyrrolidine - Trisubstituted imidazole - Fluorobenzene - Aminopyrimidine - Halobenzene - Secondary aliphatic/aromatic amine - Meta-dioxane - Monocyclic benzene moiety - Aryl halide - Benzenoid - Pyrimidine - Aryl fluoride - Pyrrolidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Secondary alcohol - Carboxamide group - Monocarboxylic acid or derivatives - Azacycle - Oxacycle - Acetal - Carboxylic acid derivative - Carboxylic acid - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Alcohol - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylimidazoles. These are polycyclic aromatic compounds containing a benzene ring linked to an imidazole ring through a CC or CN bond.
External Descriptors
Not available