Compound Identification
SMILES
[Cl-].CCN(CC)C(=O)C1=CC=C(C=C1)N=C(N)[NH2+]C(N)=N
InChIKey
InChIKey=DJJWHFXPPUBIKS-UHFFFAOYSA-N
Formula
C13H21ClN6O
Mass
312.8
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
Benzamides Benzoyl derivatives Biguanides Tertiary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Carboximidamides Organopnictogen compounds Organooxygen compounds Organic oxides Organic chloride salts Imines Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Guanidinobenzoic acid or derivatives - Benzamide - Benzoyl - Biguanide - Tertiary carboxylic acid amide - Carboxamide group - Guanidine - Carboxylic acid derivative - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organooxygen compound - Organonitrogen compound - Imine - Organic chloride salt - Hydrocarbon derivative - Organic oxide - Organic salt - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - 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