Compound Identification
SMILES
OC1=C(C(N(CCC[N+]2=CNC=C2)C1=O)C1=CC=C(F)C=C1)C(=O)C1=CC2=CC=CC=C2O1
InChIKey
InChIKey=SQLYRBXDKDZBRR-UHFFFAOYSA-O
Formula
C25H21FN3O4
Mass
446.458
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
Benzofurans Aryl ketones Pyrroline carboxylic acids and derivatives Fluorobenzenes Aryl fluorides N-substituted imidazoles Vinylogous acids Heteroaromatic compounds Furans Pyrroles Tertiary carboxylic acid amides Lactams Enols Azacyclic compounds Oxacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - Benzofuran - Pyrroline carboxylic acid or derivatives - Aryl ketone - Halobenzene - Fluorobenzene - Benzenoid - N-substituted imidazole - Aryl halide - Aryl fluoride - Monocyclic benzene moiety - Vinylogous acid - Azole - Tertiary carboxylic acid amide - Pyrrole - Furan - Imidazole - Heteroaromatic compound - Carboxamide group - Lactam - Ketone - Oxacycle - Azacycle - Carboxylic acid derivative - Enol - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic cation - Aromatic heteropolycyclic 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