Compound Identification
SMILES
O[C@@H](C([O-])=O)C1=CC=CC=C1.N#C[C@H]([NH2+]CC1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=GHHBCHYZOBUKCD-FTZKBYQMSA-N
Formula
C23H22N2O3
Mass
374.44
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 Aralkylamines Quaternary ammonium salts Secondary alcohols Carboxylic acid salts Alpha-aminonitriles Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Organic zwitterions Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols
Molecular Framework
Not available
Substituents
Benzylamine - Phenylmethylamine - Aralkylamine - Quaternary ammonium salt - Carboxylic acid salt - Secondary alcohol - Alpha-aminonitrile - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Cyanide - Amine - Aromatic alcohol - Alcohol - Organic zwitterion - Carbonyl group - Organic nitrogen compound - 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