Compound Identification
SMILES
COC1=C(OC)C(OC)=C2C(CC[C@H](NC(C)=O)C3=CC(=O)C(NCCC4=CC=C(Cl)C=C4)=CC=C23)=C1
InChIKey
InChIKey=JYWCORWAANUPBO-QHCPKHFHSA-N
Formula
C29H31ClN2O5
Mass
523.03
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenethylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenethylamines
Alternative Parents
Tropones Anisoles Secondary alkylarylamines Chlorobenzenes Aralkylamines Alkyl aryl ethers Aryl chlorides Acetamides Secondary carboxylic acid amides Cyclic ketones Amino acids and derivatives Organochlorides Organic oxides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Phenethylamine - Anisole - Tropone - Phenol ether - Alkyl aryl ether - Halobenzene - Aralkylamine - Chlorobenzene - Secondary aliphatic/aromatic amine - Aryl chloride - Aryl halide - Acetamide - Amino acid or derivatives - Cyclic ketone - Carboxamide group - Secondary carboxylic acid amide - Ether - Carboxylic acid derivative - Secondary amine - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenethylamines. These are compounds containing a phenethylamine moiety, which consists of a phenyl group substituted at the second position by an ethan-1-amine.
External Descriptors
Not available