Compound Identification
SMILES
CCOC(=O)C1CN(CC1=O)C(C)=O
InChIKey
InChIKey=KHFQTWZABTWLRK-UHFFFAOYSA-N
Formula
C9H13NO4
Mass
199.206
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
-
Subclass
Pyrrolidones
- Level 5 Oxoprolines
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Subclass
Pyrrolidones
-
Class
Pyrrolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Pyrrolidones
Intermediate Tree Nodes
Not available
Direct Parent
Oxoprolines
Alternative Parents
Pyrrolidine carboxylic acids N-acylpyrrolidines Pyrrolidine-3-ones 1,3-dicarbonyl compounds Tertiary carboxylic acid amides Acetamides Cyclic ketones Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
N-acylpyrrolidine - Oxoproline - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - 1,3-dicarbonyl compound - 3-pyrrolidone - Acetamide - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Ketone - Cyclic ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organonitrogen compound - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as oxoprolines. These are compounds containing an oxoproline moiety, which consists of a pyrrolidine ring bearing a carboxylic acid group at the ring position 2, and a ketone group.
External Descriptors
Not available