Structure Information
Structure

Compound Identification

SMILES

OC1=CC=C(N[C@H](C2=NN=C(O2)C2=CC=CC=C2)C2=C(Cl)C=C(F)C=C2)C=C1

InChIKey

InChIKey=IGEMDBPBXCKKJX-IBGZPJMESA-N

Formula

C21H15ClFN3O2

Mass

395.82

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic nitrogen compounds

Class

Organonitrogen compounds

Subclass

Amines

Intermediate Tree Nodes

Aralkylamines

Direct Parent

Phenylalkylamines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

P-aminophenol - Aminophenol - Phenylalkylamine - Aniline or substituted anilines - 1-hydroxy-2-unsubstituted benzenoid - Chlorobenzene - Fluorobenzene - Halobenzene - Phenol - Secondary aliphatic/aromatic amine - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Oxadiazole - Heteroaromatic compound - 1,3,4-oxadiazole - Azole - Oxacycle - Azacycle - Secondary amine - Organoheterocyclic compound - Organooxygen compound - Organofluoride - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylalkylamines. These are organic amines where the amine group is secondary and linked on one end to a phenyl group and on the other end, to an alkyl group.

External Descriptors

Not available

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