Compound Identification
SMILES
COC1=C(Cl)C=C(C=C1)N1C(=O)[C@@H]2N=NN(CC3=C(C)C=CC(C)=C3)[C@@H]2C1=O
InChIKey
InChIKey=HKJXTJIJQMMCNG-MSOLQXFVSA-N
Formula
C20H19ClN4O3
Mass
398.85
Taxonomic Classification
Taxonomy Tree
-
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
Alpha amino acids and derivatives Methoxyanilines p-Xylenes Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Chlorobenzenes N-substituted carboxylic acid imides Aryl chlorides Pyrrolidine-2-ones Triazolines Dicarboximides Pyrroles Lactams Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Alpha-amino acid or derivatives - Methoxyaniline - Phenol ether - Phenoxy compound - Methoxybenzene - Xylene - P-xylene - Anisole - Alkyl aryl ether - Chlorobenzene - Halobenzene - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - Aryl halide - Pyrrolidone - 2-pyrrolidone - Aryl chloride - Benzenoid - Triazoline - Carboxylic acid imide - Dicarboximide - Pyrrole - Lactam - Propargyl-type 1,3-dipolar organic compound - Ether - Organic 1,3-dipolar compound - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - 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