Compound Identification
SMILES
CC(CO)CNCC1=C(O)C(CO)=CC=C1
InChIKey
InChIKey=GQYUQVKKEFMDTI-UHFFFAOYSA-N
Formula
C12H19NO3
Mass
225.288
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylmethylamines
-
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
Benzylamines Benzyl alcohols Aralkylamines 1-hydroxy-4-unsubstituted benzenoids 1,3-aminoalcohols Dialkylamines Primary alcohols Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzyl alcohol - Benzylamine - Phenylmethylamine - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Aralkylamine - 1,3-aminoalcohol - Secondary amine - Secondary aliphatic amine - Primary alcohol - Organic oxygen compound - Alcohol - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Aromatic alcohol - Amine - Hydrocarbon derivative - Aromatic homomonocyclic 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