Compound Identification
SMILES
COC1=CC(OC[C@H](O)CN2CCN(CC3=CC=C(Cl)C=C3)CC2)=CC=C1
InChIKey
InChIKey=IEBBGKVGFVJBHA-LJQANCHMSA-N
Formula
C21H27ClN2O3
Mass
390.91
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 Methoxybenzenes Benzylamines Anisoles N-alkylpiperazines Chlorobenzenes Aralkylamines Alkyl aryl ethers Aryl chlorides Trialkylamines Secondary alcohols 1,2-aminoalcohols Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzylamine - Phenol ether - Phenylmethylamine - Methoxybenzene - Anisole - Phenoxy compound - Aralkylamine - N-alkylpiperazine - Halobenzene - Alkyl aryl ether - Chlorobenzene - Aryl halide - Piperazine - Aryl chloride - 1,4-diazinane - Tertiary aliphatic amine - Tertiary amine - Secondary alcohol - 1,2-aminoalcohol - Azacycle - Organoheterocyclic compound - Ether - Organonitrogen compound - Organooxygen compound - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organochloride - Organic oxygen compound - Organohalogen compound - 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