Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(COC(=O)N(CC=C)C2CCN(C[C@H]3CN4O[C@@H](C[C@H]4[C@@H]3C3=CC=CC=C3)C3=CC=CC=C3)CC2)C=C1
InChIKey
InChIKey=PTAWGYLKONHXLB-TUONYQKMSA-N
Formula
C35H40N4O5
Mass
596.728
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
Phenylisoxazolidines Benzyloxycarbonyls Nitrobenzenes Nitroaromatic compounds Aralkylamines Piperidines Pyrroles Carbamate esters Trialkylamines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Azacyclic compounds N-organohydroxylamines Organic salts Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylisoxazolidine - 3-phenylpyrrolidine - Benzyloxycarbonyl - Nitrobenzene - Nitroaromatic compound - Aralkylamine - Monocyclic benzene moiety - Piperidine - Benzenoid - Isoxazolidine - Pyrrole - Carbamic acid ester - C-nitro compound - Organic nitro compound - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Organic oxoazanium - Azacycle - N-organohydroxylamine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Organic salt - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic cation - 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