Compound Identification
SMILES
CCOC(=O)C1=C(O)C(C(O)=O)=C(N1C)C1=CC=CS1
InChIKey
InChIKey=ULVYUEXTMXNONJ-UHFFFAOYSA-N
Formula
C13H13NO5S
Mass
295.31
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
-
Subclass
Pyrrole carboxylic acids and derivatives
- Level 5 Pyrrole carboxylic acids
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Subclass
Pyrrole carboxylic acids and derivatives
-
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
Alternative Parents
N-methylpyrroles Vinylogous amides Vinylogous acids Thiophenes Heteroaromatic compounds Carboxylic acid esters Carboxylic acids Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrrole-3-carboxylic acid - N-methylpyrrole - Substituted pyrrole - Thiophene - Vinylogous acid - Vinylogous amide - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Carboxylic acid - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrole carboxylic acids. These are heterocyclic compounds containing a pyrrole ring bearing a carboxyl group.
External Descriptors
Not available