Compound Identification
SMILES
OC1=C(C(N(CC2=C[NH+]=CC=C2)C1=O)C1=CC=C(F)C=C1)C(=O)C1=CC=CO1
InChIKey
InChIKey=WBUKVYJZBVYBOL-UHFFFAOYSA-O
Formula
C21H16FN2O4
Mass
379.367
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyrrolines
- Subclass Phenylpyrrolines
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Class
Pyrrolines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolines
Subclass
Phenylpyrrolines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolines
Alternative Parents
Pyrroline carboxylic acids and derivatives Aryl ketones Fluorobenzenes Pyridinium derivatives Aryl fluorides Vinylogous acids Tertiary carboxylic acid amides Pyrroles Furans Heteroaromatic compounds Lactams Oxacyclic compounds Azacyclic compounds Enols Organofluorides Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrroline - Pyrroline carboxylic acid or derivatives - Aryl ketone - Fluorobenzene - Halobenzene - Aryl halide - Monocyclic benzene moiety - Aryl fluoride - Benzenoid - Pyridinium - Pyridine - Heteroaromatic compound - Vinylogous acid - Tertiary carboxylic acid amide - Furan - Pyrrole - Carboxamide group - Ketone - Lactam - Oxacycle - Azacycle - Carboxylic acid derivative - Enol - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organofluoride - Organic cation - 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