Compound Identification
SMILES
COC(=O)C1=CC(OCC2CN(CC3=CC=C(C=C3)N3C=CN=C3)CCO2)=CN=C1
InChIKey
InChIKey=DCCPURBAGPIERP-UHFFFAOYSA-N
Formula
C22H24N4O4
Mass
408.458
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
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Imidazoles
Intermediate Tree Nodes
Substituted imidazoles
Direct Parent
Phenylimidazoles
Alternative Parents
Pyridinecarboxylic acids Benzylamines Imidazolyl carboxylic acids and derivatives Phenylmethylamines Alkyl aryl ethers Aralkylamines N-substituted imidazoles Morpholines Methyl esters Heteroaromatic compounds Amino acids and derivatives Trialkylamines Dialkyl ethers Azacyclic compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylimidazole - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Benzylamine - Imidazolyl carboxylic acid derivative - Phenylmethylamine - Alkyl aryl ether - Aralkylamine - Monocyclic benzene moiety - Morpholine - N-substituted imidazole - Oxazinane - Pyridine - Benzenoid - Heteroaromatic compound - Methyl ester - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Oxacycle - Azacycle - Carboxylic acid derivative - Ether - Dialkyl ether - Organic oxygen compound - Organic oxide - Amine - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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