Compound Identification
SMILES
COC1=C(O)C=CC(=C1)C1NC(CC2=CC=C(C=C2)[N+]([O-])=O)(C2C1C(=O)N(C2=O)C1=CC(=CC=C1)[N+]([O-])=O)C(O)=O
InChIKey
InChIKey=BIFMNHIYKFIJIF-UHFFFAOYSA-N
Formula
C27H22N4O10
Mass
562.491
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
Phenylpropanoic acids Methoxyphenols Amphetamines and derivatives Alpha amino acids Nitrobenzenes Phenoxy compounds Nitroaromatic compounds Anisoles Methoxybenzenes Pyrrolidine carboxylic acids Alkyl aryl ethers Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Pyrrolidine-2-ones N-substituted carboxylic acid imides Dicarboximides Pyrroles Lactams Amino acids Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Dialkylamines Hydrocarbon derivatives Organic zwitterions Carbonyl compounds Organic oxides Organic salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - 1-phenylpyrrolidine - 3-phenylpropanoic-acid - Methoxyphenol - Amphetamine or derivatives - Alpha-amino acid or derivatives - Alpha-amino acid - Nitrobenzene - Nitroaromatic compound - Pyrrolidine carboxylic acid - Phenol ether - Methoxybenzene - Pyrrolidine carboxylic acid or derivatives - Anisole - Phenoxy compound - Aralkylamine - Alkyl aryl ether - Phenol - 1-hydroxy-2-unsubstituted benzenoid - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide, n-substituted - Benzenoid - Monocyclic benzene moiety - Carboxylic acid imide - Dicarboximide - Pyrrole - Amino acid - Organic nitro compound - C-nitro compound - Lactam - Amino acid or derivatives - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid - Secondary aliphatic amine - Allyl-type 1,3-dipolar organic compound - Ether - Secondary amine - Monocarboxylic acid or derivatives - Organic oxoazanium - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic salt - Organic zwitterion - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organic oxide - 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