Compound Identification
SMILES
CC(=O)C1=C(O)C(=O)N(CCCCCC([O-])=O)[C@H]1C1=CC=CC=C1
InChIKey
InChIKey=IINIQSYJRNTYTO-INIZCTEOSA-M
Formula
C18H20NO5
Mass
330.361
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolines
- Subclass Phenylpyrrolines
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Class
Pyrrolines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolines
Subclass
Phenylpyrrolines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolines
Alternative Parents
Medium-chain fatty acids Amino fatty acids Heterocyclic fatty acids Hydroxy fatty acids Benzene and substituted derivatives Vinylogous acids Tertiary carboxylic acid amides Pyrroles Carboxylic acid salts Lactams Ketones Azacyclic compounds Carboxylic acids Enols Monocarboxylic acids and derivatives Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrroline - Medium-chain fatty acid - Amino fatty acid - Heterocyclic fatty acid - Hydroxy fatty acid - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Vinylogous acid - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Carboxylic acid salt - Ketone - Lactam - Carboxylic acid derivative - Carboxylic acid - Enol - Azacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic anion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrrolines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrroline ring through a CC or CN bond.
External Descriptors
Not available