Compound Identification
SMILES
[O-][N+](=O)C1=CC=CC(C=C2C(=O)N(C3=C2C(N(C3=O)C2=CC=CC=C2)C2=CC=C(Cl)C=C2)C2=CC=CC=C2)=C1
InChIKey
InChIKey=XSLFJMDDGLCIIJ-UHFFFAOYSA-N
Formula
C31H20ClN3O4
Mass
533.97
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
Alpha amino acids and derivatives Nitrobenzenes Nitroaromatic compounds Chlorobenzenes Aryl chlorides Tertiary carboxylic acid amides Pyrroles Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic oxides Hydrocarbon derivatives Organic salts Carbonyl compounds Organic zwitterions Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrroline - 2-phenylpyrroline - Alpha-amino acid or derivatives - Nitrobenzene - Nitroaromatic compound - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Benzenoid - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Pyrrole - Lactam - C-nitro compound - Organic nitro compound - Carboxamide group - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic salt - Organic nitrogen compound - Organic zwitterion - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - 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