Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)[C@@H](C)N(CC1=CC=CC=C1)[C@@H](CC(=O)OC(C)(C)C)C1=CC=CC=C1Br

InChIKey

InChIKey=PCOLVSGPLPGUAI-ZBLYBZFDSA-N

Formula

C29H34BrNO3

Mass

524.499

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenylmethylamines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylmethylamines

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Anisole - Phenoxy compound - Benzylamine - Phenol ether - Phenylmethylamine - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Fatty acid ester - Halobenzene - Aralkylamine - Fatty acyl - Aryl bromide - Aryl halide - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Organic oxide - Carbonyl group - Amine - Organic oxygen compound - Organohalogen compound - Organobromide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.

External Descriptors

Not available

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