Structure Information
Structure

Compound Identification

SMILES

CCC1=CC=C(C=C1)C1=CC([NH2+]C(N1)C1=CC=CC=C1OC)C1=C(O)C=CC(Br)=C1

InChIKey

InChIKey=DTJLLTMVQNYUKH-UHFFFAOYSA-O

Formula

C25H26BrN2O2

Mass

466.398

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenol ethers

Subclass

Anisoles

Intermediate Tree Nodes

Not available

Direct Parent

Anisoles

Alternative Parents

Phenoxy compounds P-bromophenols Methoxybenzenes Bromobenzenes Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Hydropyrimidines Aryl bromides Quaternary ammonium salts Enamines Azacyclic compounds Organobromides Hydrocarbon derivatives Organic cations

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenoxy compound - Anisole - Methoxybenzene - 4-bromophenol - 4-halophenol - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Bromobenzene - Phenol - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - 1,2,3,4-tetrahydropyrimidine - Quaternary ammonium salt - Azacycle - Organoheterocyclic compound - Enamine - Ether - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.

External Descriptors

Not available

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