Structure Information
Structure

Compound Identification

SMILES

C(CC1=CC=C(COC2=CC=CC=C2)C=C1)C[N+]1(CC2=CC=CC=C2)CCOCC1

InChIKey

InChIKey=QCKBIAMCQIDMRD-UHFFFAOYSA-N

Formula

C27H32NO2

Mass

402.557

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenylpropylamines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpropylamines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenylpropylamine - Phenoxy compound - Benzylamine - Phenol ether - Phenylmethylamine - Alkyl aryl ether - Aralkylamine - Morpholine - Oxazinane - Quaternary ammonium salt - Tetraalkylammonium salt - Organoheterocyclic compound - Ether - Dialkyl ether - Oxacycle - Azacycle - Hydrocarbon derivative - Organopnictogen compound - Amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpropylamines. These are compounds containing a phenylpropylamine moiety, which consists of a phenyl group substituted at the third carbon by an propan-1-amine.

External Descriptors

Not available

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