Compound Identification
SMILES
COCCN1[C@H](C(C(=O)C2=CC=CO2)=C([O-])C1=O)C1=CC=C(C=C1)C(C)(C)C
InChIKey
InChIKey=ISMLOQJFUYBSTC-SFHVURJKSA-M
Formula
C22H24NO5
Mass
382.437
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
Phenylpropanes Aryl ketones Pyrroline carboxylic acids and derivatives Vinylogous acids Furans Heteroaromatic compounds Tertiary carboxylic acid amides Pyrroles Lactams Amino acids and derivatives Tertiary amines Azacyclic compounds Oxacyclic compounds Dialkyl ethers Hydrocarbon derivatives Organic oxides Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrroline - Phenylpropane - Pyrroline carboxylic acid or derivatives - Aryl ketone - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Vinylogous acid - Furan - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Amino acid or derivatives - Tertiary amine - Ketone - Lactam - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Carbonyl group - Organic oxide - Hydrocarbon derivative - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - 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