Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C2C(N(CCC2=C1)C(=O)C(C)C)C1=C(F)C=CC(Br)=C1

InChIKey

InChIKey=NTKJVAPXHXUQAG-UHFFFAOYSA-N

Formula

C21H23BrFNO3

Mass

436.321

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Tetrahydroisoquinolines

Subclass

1-phenyltetrahydroisoquinolines

Intermediate Tree Nodes

Not available

Direct Parent

1-phenyltetrahydroisoquinolines

Alternative Parents

Anisoles Fluorobenzenes Bromobenzenes Alkyl aryl ethers Aryl fluorides Aryl bromides Tertiary carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organofluorides Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-phenyltetrahydroisoquinoline - Anisole - Alkyl aryl ether - Bromobenzene - Fluorobenzene - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Ether - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organobromide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-phenyltetrahydroisoquinolines. These are compounds containing a phenyl group attached to the C1-atom of a tetrahydroisoquinoline moiety.

External Descriptors

Not available

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