Structure Information
Structure

Compound Identification

SMILES

CC1=CC=CC=C1[B-](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1.COC1=CC2=C(C=C1)N(C)\C(=C\C=C\C1=[N+](C)C3=C(C=C(OC)C=C3)C1(C)C)C2(C)C

InChIKey

InChIKey=KEHAQXXYKYLIQB-UHFFFAOYSA-N

Formula

C52H55BN2O2

Mass

750.83

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Indoles

Intermediate Tree Nodes

Not available

Direct Parent

3-alkylindoles

Alternative Parents

Tertiary alkylarylamines Anisoles Toluenes Alkyl aryl ethers Propargyl-type 1,3-dipolar organic compounds Enamines Azacyclic compounds Organometalloid compounds Hydrocarbon derivatives Organic cations

Molecular Framework

Not available

Substituents

3-alkylindole - Anisole - Phenol ether - Tertiary aliphatic/aromatic amine - Alkyl aryl ether - Toluene - Monocyclic benzene moiety - Benzenoid - Tertiary amine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Ether - Enamine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic metalloid moeity - Organic nitrogen compound - Organic oxygen compound - Amine - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 3-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 3-position.

External Descriptors

Not available

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