Compound Identification
SMILES
CC(C)C(NC(=O)COC(=O)C1=CC=C(C=C1)N=C(N)N)C(N)=O
InChIKey
InChIKey=KNOAYPRLKYLTHH-UHFFFAOYSA-N
Formula
C15H21N5O4
Mass
335.364
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Aminobenzoic acids and derivatives
Direct Parent
Guanidinobenzoic acids and derivatives
Alternative Parents
Valine and derivatives N-acyl-alpha amino acids and derivatives Benzoic acid esters Benzoyl derivatives Fatty amides Secondary carboxylic acid amides Primary carboxylic acid amides Guanidines Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Valine or derivatives - Guanidinobenzoic acid or derivatives - N-acyl-alpha amino acid or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzoate ester - Benzoyl - Fatty acyl - Fatty amide - Carboxamide group - Carboxylic acid ester - Guanidine - Secondary carboxylic acid amide - Primary carboxylic acid amide - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as guanidinobenzoic acids and derivatives. These are aromatic compounds containing a guanidine group linked to the benzene ring of a benzoic acid (or a derivative thereof).
External Descriptors
Not available