Structure Information
Structure

Compound Identification

SMILES

CCCCN1C(CN(CC2=CC3=C(OCO3)C=C2)CC2=CC3=C(OCCO3)C=C2)=C(Cl)N=C1C1=CC=CC=C1

InChIKey

InChIKey=RLMBEOUWVBHHMJ-UHFFFAOYSA-N

Formula

C31H32ClN3O4

Mass

546.06

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Imidazoles

Intermediate Tree Nodes

Substituted imidazoles

Direct Parent

Phenylimidazoles

Alternative Parents

Benzo-1,4-dioxanes 1,2,4,5-tetrasubstituted imidazoles Benzodioxoles Alkyl aryl ethers Aralkylamines Para dioxins Aryl chlorides Benzene and substituted derivatives N-substituted imidazoles Heteroaromatic compounds Trialkylamines Azacyclic compounds Acetals Oxacyclic compounds Organopnictogen compounds Organochlorides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-phenylimidazole - Benzo-1,4-dioxane - Benzodioxane - 1,2,4,5-tetrasubstituted imidazole - Benzodioxole - Alkyl aryl ether - Aralkylamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Para-dioxin - Benzenoid - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Azacycle - Oxacycle - Acetal - Ether - Organooxygen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Amine - Organohalogen compound - Organochloride - Organonitrogen compound - Organic nitrogen compound - Aromatic heteropolycyclic 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

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