Structure Information
Structure

Compound Identification

SMILES

OCC(Br)(CO)[N+]([O-])=O.COC(=O)NC1=NC2=CC=CC=C2N1

InChIKey

InChIKey=NGUCNCSFOGXRAS-UHFFFAOYSA-N

Formula

C12H15BrN4O6

Mass

391.178

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzimidazoles

Subclass

2-benzimidazolylcarbamic acid esters

Intermediate Tree Nodes

Not available

Direct Parent

2-benzimidazolylcarbamic acid esters

Alternative Parents

Molecular Framework

Not available

Substituents

2-benzimidazolylcarbamic acid ester - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Carbamic acid ester - Bromohydrin - Halohydrin - C-nitro compound - Carbonic acid derivative - Organic nitro compound - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Organobromide - Alkyl bromide - Organohalogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Primary alcohol - Alkyl halide - Organic zwitterion - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-benzimidazolylcarbamic acid esters. These are aromatic heteropolycyclic compounds that contain a carbamic acid ester group, which is N-linked to the C2-atom of a benzimidazole moiety.

External Descriptors

Not available

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