Compound Identification
SMILES
[Cl-].CCOC(=O)C1=C(N=C(N)[NH3+])C(=CN1)[C@@H](CO)C1=CC=CC=C1F
InChIKey
InChIKey=CBMNYNAQGMXYPF-MERQFXBCSA-N
Formula
C16H20ClFN4O3
Mass
370.81
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrroles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroles
Subclass
Pyrrole carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrole carboxylic acids and derivatives
Alternative Parents
Fluorobenzenes Substituted pyrroles Aryl fluorides Quaternary ammonium salts Heteroaromatic compounds Guanidines Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Primary alcohols Organofluorides Organic zwitterions Organic oxides Organic chloride salts Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrrole-2-carboxylic acid or derivatives - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Quaternary ammonium salt - Carboxylic acid ester - Guanidine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Carboxylic acid derivative - Organic salt - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxide - Alcohol - Organic oxygen compound - Primary alcohol - Organic chloride salt - Organic nitrogen compound - Hydrocarbon derivative - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrole carboxylic acids and derivatives. These are heterocyclic compounds containing a pyrrole ring bearing a carboxyl group (or a derivative thereof).
External Descriptors
Not available