Compound Identification
SMILES
COC1=C(OCC2=CC=CC=C2F)C(Cl)=CC(C[NH2+]CC[NH+]2CCOCC2)=C1
InChIKey
InChIKey=MZGMRPPQNLSDMK-UHFFFAOYSA-P
Formula
C21H28ClFN2O3
Mass
410.91
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylmethylamines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylmethylamines
Alternative Parents
Phenoxy compounds Anisoles Methoxybenzenes Benzylamines Alkyl aryl ethers Aralkylamines Fluorobenzenes Chlorobenzenes Aryl chlorides Morpholines Aryl fluorides Quaternary ammonium salts Trialkylamines Oxacyclic compounds Azacyclic compounds Dialkylamines Dialkyl ethers Hydrocarbon derivatives Organofluorides Organochlorides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzylamine - Phenoxy compound - Anisole - Phenol ether - Phenylmethylamine - Methoxybenzene - Fluorobenzene - Halobenzene - Chlorobenzene - Alkyl aryl ether - Aralkylamine - Aryl chloride - Oxazinane - Aryl halide - Morpholine - Aryl fluoride - Quaternary ammonium salt - Tertiary amine - Tertiary aliphatic amine - Secondary amine - Oxacycle - Ether - Dialkyl ether - Organoheterocyclic compound - Secondary aliphatic amine - Azacycle - Organic nitrogen compound - Amine - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic 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