Structure Information
Structure

Compound Identification

SMILES

COCCN1C(=NC2=C(I)C(CC3=CC=CC=C3)=CC(OC)=C12)C1=CC=C(C=C1)C(C)C

InChIKey

InChIKey=LJXFBDRQRHPPMK-UHFFFAOYSA-N

Formula

C27H29IN2O2

Mass

540.445

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzimidazoles

Subclass

Phenylbenzimidazoles

Intermediate Tree Nodes

Not available

Direct Parent

Phenylbenzimidazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenylbenzimidazole - 2-phenylimidazole - Monoterpenoid - Bicyclic monoterpenoid - Aromatic monoterpenoid - P-cymene - Phenylpropane - Cumene - Anisole - Alkyl aryl ether - Benzenoid - N-substituted imidazole - Monocyclic benzene moiety - Aryl iodide - Aryl halide - Heteroaromatic compound - Imidazole - Azole - Azacycle - Ether - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organoiodide - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylbenzimidazoles. These are compounds containing a phenylbenzimidazole skeleton, which consists of a benzimidazole moiety where its imidazole ring is attached to a phenyl group.

External Descriptors

Not available

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