Compound Identification
SMILES
OCC#CC1=CC=C(CNC2=CC(O)=C(C=C2)C(O)=O)C=C1
InChIKey
InChIKey=BFFUVFADGDVQRH-UHFFFAOYSA-N
Formula
C17H15NO4
Mass
297.31
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Phenylmethylamines
- Level 5 Phenylbenzamines
-
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
Phenylbenzamines
Alternative Parents
4-aminosalicylic acids Aminosalicylic acids Aminobenzoic acids Salicylic acids Benzoic acids m-Aminophenols Aniline and substituted anilines Benzoyl derivatives Benzylamines Phenylalkylamines 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Secondary alkylarylamines Vinylogous acids Amino acids Carboxylic acids Primary alcohols Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylbenzamine - 4-aminosalicylic acid - Aminosalicylic acid - Aminosalicylic acid or derivatives - Salicylic acid or derivatives - Aminobenzoic acid - Aminobenzoic acid or derivatives - Salicylic acid - Hydroxybenzoic acid - Benzoic acid or derivatives - Benzoic acid - Aminophenol - Benzoyl - Benzylamine - M-aminophenol - Aniline or substituted anilines - Phenylalkylamine - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Secondary aliphatic/aromatic amine - Phenol - Vinylogous acid - Amino acid - Amino acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Secondary amine - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alcohol - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Primary alcohol - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbenzamines. These are aromatic compounds consisting of a benzyl group that is N-linked to a benzamine.
External Descriptors
Not available