Compound Identification
SMILES
COC(=O)COC1=C(OCC(=O)OC)C=C(C=C1)C1=NC(=CN1C)C1=CC=C(C=C1)C(N)=N
InChIKey
InChIKey=MNSJMKBULUWOLD-UHFFFAOYSA-N
Formula
C23H24N4O6
Mass
452.467
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
Phenoxyacetic acid derivatives Phenoxy compounds Phenol ethers 1,2,4-trisubstituted imidazoles Imidazolyl carboxylic acids and derivatives Alkyl aryl ethers N-substituted imidazoles Dicarboxylic acids and derivatives Methyl esters Heteroaromatic compounds Carboximidamides Carboxamidines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxyacetate - 4-phenylimidazole - 5-phenylimidazole - 2-phenylimidazole - 1,2,4-trisubstituted-imidazole - Phenoxy compound - Imidazolyl carboxylic acid derivative - Phenol ether - Trisubstituted imidazole - Alkyl aryl ether - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - N-substituted imidazole - Benzenoid - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Azacycle - Ether - Carboxylic acid derivative - Carboxylic acid amidine - Amidine - Carboximidamide - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - 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