Compound Identification
SMILES
CN1N=C(C(C1=O)=C1C(=O)N(C([O-])=C1[N+]1=CC(C)=CC(C)=C1)C1=CC=CC=C1F)C1=CC=CC=C1
InChIKey
InChIKey=BUFYGLUAGLSZRB-UHFFFAOYSA-N
Formula
C27H21FN4O3
Mass
468.488
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
Fluorobenzenes Methylpyridines Pyridinium derivatives Pyrazolones Aryl fluorides Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Lactams Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides Organic salts Carbonyl compounds Organofluorides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrroline - Fluorobenzene - Halobenzene - Methylpyridine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Pyrazolinone - Pyridine - Pyridinium - Benzenoid - Pyrrole - Heteroaromatic compound - Pyrazoline - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Carbonyl group - Organofluoride - Organohalogen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organic oxide - Organic salt - 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