Structure Information
Structure

Compound Identification

SMILES

CCC1=CC=C(C=C1)C1=NC2=C(N1)C=CC=C2N1CCN(CCOC2=CC(O)=C(C=C2)[N+]([O-])=O)CC1

InChIKey

InChIKey=IECYTSHSWSIEBJ-UHFFFAOYSA-N

Formula

C27H29N5O4

Mass

487.56

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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 - N-arylpiperazine - Nitrophenyl ether - 2-phenylimidazole - Nitrophenol - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Phenol ether - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - N-alkylpiperazine - Phenol - Piperazine - Monocyclic benzene moiety - 1,4-diazinane - Benzenoid - Heteroaromatic compound - Azole - Imidazole - C-nitro compound - Organic nitro compound - Tertiary aliphatic amine - Tertiary amine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Azacycle - Ether - Allyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Organic salt - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic zwitterion - Organic oxygen 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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