Compound Identification
SMILES
COC1=CC=C(C=C1)C12C(CC3C4C(CC=C3C1C=CC1=CC(OC)=C(O)C=C1)C(=O)N(C4=O)C1=CC=CC(=C1)B(O)O)C(=O)N(NC1=C(Cl)C=C(Cl)C=C1)C2=O
InChIKey
InChIKey=AFKRIEOXXUULCJ-UHFFFAOYSA-N
Formula
C42H36BCl2N3O9
Mass
808.47
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Isoindolones Methoxyphenols Dichlorobenzenes Styrenes Methoxybenzenes Anisoles Phenoxy compounds Phenylhydrazines Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides N-substituted carboxylic acid imides Pyrrolidine-2-ones Dicarboximides Pyrroles Lactams Boronic acids Carboxylic acid hydrazides Organic metalloid salts Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organometalloid compounds Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - 3-phenylpyrrolidine - Methoxyphenol - Isoindolone - Isoindoline - Isoindole or derivatives - Phenylhydrazine - Phenoxy compound - 1,3-dichlorobenzene - Phenol ether - Styrene - Anisole - Methoxybenzene - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Chlorobenzene - Phenol - Halobenzene - Pyrrolidone - 2-pyrrolidone - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Carboxylic acid imide, n-substituted - Carboxylic acid imide - Dicarboximide - Pyrrole - Lactam - Boronic acid derivative - Boronic acid - Carboxylic acid hydrazide - Azacycle - Ether - Carboxylic acid derivative - Organic metalloid salt - Organohalogen compound - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic metalloid moeity - Organochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrrolidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrolidine ring through a CC or CN bond. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
External Descriptors
Not available