Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC)[C@H]1C\C(C[C@@H]2[C@H]1C(=O)N(C2=O)C1=CC=CC=C1)=N/NC1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=ITBOSAXOLMVFTK-NFJSIMHHSA-N
Formula
C29H28N4O7
Mass
544.564
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 Isoindoles Nitrobenzenes Phenylhydrazines Phenoxy compounds Anisoles Nitroaromatic compounds Methoxybenzenes Alkyl aryl ethers Pyrrolidine-2-ones N-substituted carboxylic acid imides Pyrroles Dicarboximides Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrazones Organic oxoazanium compounds Organic salts Organic zwitterions Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Isoindolone - Isoindoline - Isoindole - Isoindole or derivatives - Nitrobenzene - Anisole - Phenoxy compound - Nitroaromatic compound - Phenol ether - Phenylhydrazine - Methoxybenzene - Alkyl aryl ether - Benzenoid - Carboxylic acid imide, n-substituted - 2-pyrrolidone - Pyrrolidone - Monocyclic benzene moiety - Carboxylic acid imide - Dicarboximide - Pyrrole - C-nitro compound - Lactam - Organic nitro compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Azacycle - Ether - Allyl-type 1,3-dipolar organic compound - Hydrazone - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Organic oxide - Organonitrogen compound - Organic salt - Organooxygen compound - Carbonyl group - 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