Compound Identification
SMILES
COC(=O)C1=CC=C(CN2C(=O)NC(=CC3=C(OC)C=C(C=C3)N3CCCC3)C2=O)O1
InChIKey
InChIKey=MFHUBFSSVOSSFQ-UHFFFAOYSA-N
Formula
C22H23N3O6
Mass
425.441
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
Hydantoins Alpha amino acids and derivatives Furoic acid esters Aminophenyl ethers Methoxyanilines Methoxybenzenes Dialkylarylamines Anisoles Phenoxy compounds N-acyl ureas Alkyl aryl ethers Methyl esters Pyrroles Heteroaromatic compounds Dicarboximides Monocarboxylic acids and derivatives Azacyclic compounds Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hydantoin - 1-phenylpyrrolidine - Alpha-amino acid or derivatives - Furoic acid ester - Methoxyaniline - Aminophenyl ether - Phenol ether - Furoic acid or derivatives - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Phenoxy compound - Methoxybenzene - Anisole - Alkyl aryl ether - Ureide - N-acyl urea - Monocyclic benzene moiety - Benzenoid - Imidazolidinone - Imidazolidine - Heteroaromatic compound - Dicarboximide - Methyl ester - Furan - Pyrrole - Amino acid or derivatives - Carboxylic acid ester - Carbonic acid derivative - Urea - Tertiary amine - Carboxylic acid derivative - Oxacycle - Azacycle - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Amine - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Aromatic heteromonocyclic 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