Compound Identification
SMILES
CCN(CC)CCN1C(C(C(=O)C2=CC3=CC=CC=C3O2)=C(O)C1=O)C1=CC(Cl)=CC=C1
InChIKey
InChIKey=SPXCCNDTORQFMP-UHFFFAOYSA-N
Formula
C25H25ClN2O4
Mass
452.94
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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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
Benzofurans Pyrroline carboxylic acids and derivatives Aryl ketones Chlorobenzenes Aryl chlorides Vinylogous acids Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Furans Trialkylamines Amino acids and derivatives Lactams Oxacyclic compounds Azacyclic compounds Enols Organochlorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - Benzofuran - Pyrroline carboxylic acid or derivatives - Aryl ketone - Halobenzene - Chlorobenzene - Aryl halide - Monocyclic benzene moiety - Aryl chloride - Benzenoid - Heteroaromatic compound - Furan - Pyrrole - Vinylogous acid - Tertiary carboxylic acid amide - Amino acid or derivatives - Lactam - Ketone - Tertiary amine - Carboxamide group - Tertiary aliphatic amine - Oxacycle - Azacycle - Carboxylic acid derivative - Enol - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organochloride - Organohalogen 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