Compound Identification
SMILES
CCOC(=O)C1(C)C[C@@H](CC2=C(Br)C=C(OC)C=C2)N(C)C1=O
InChIKey
InChIKey=CDXCNGKRILXRRO-MTATWXBHSA-N
Formula
C17H22BrNO4
Mass
384.27
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
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Subclass
Pyrrolidones
- Level 5 Oxoprolines
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Subclass
Pyrrolidones
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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
Anisoles Methoxybenzenes Pyrrolidine carboxylic acids Phenoxy compounds Alkyl aryl ethers Bromobenzenes N-alkylpyrrolidines Pyrrolidine-2-ones Aryl bromides Tertiary carboxylic acid amides Lactams Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Anisole - Oxoproline - Methoxybenzene - Phenol ether - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Alkyl aryl ether - Halobenzene - Bromobenzene - Aryl bromide - 2-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Monocyclic benzene moiety - Aryl halide - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactam - Ether - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organobromide - Aromatic 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