Compound Identification
SMILES
CC1=C(C=CC(OCC2=CC=CC=C2)=C1)C([O-])=C1C(N(CC2=C[NH+]=CC=C2)C(=O)C1=O)C1=CC(=CC=C1)[N+]([O-])=O
InChIKey
InChIKey=CRYIVJMFYWQZGP-UHFFFAOYSA-N
Formula
C31H25N3O6
Mass
535.556
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
Nitrobenzenes Phenoxy compounds Phenol ethers Nitroaromatic compounds Toluenes Alkyl aryl ethers Pyrrolidine-3-ones Pyrrolidine-2-ones Pyridinium derivatives N-alkylpyrrolidines Vinylogous acids Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Tertiary amines Amino acids and derivatives Cyclic ketones Lactams Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic zwitterions Organic salts Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Phenol ether - Alkyl aryl ether - Toluene - Monocyclic benzene moiety - N-alkylpyrrolidine - 3-pyrrolidone - Benzenoid - Pyridine - Pyridinium - Pyrrolidone - 2-pyrrolidone - Tertiary carboxylic acid amide - Vinylogous acid - Pyrrole - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Ketone - Lactam - C-nitro compound - Organic nitro compound - Tertiary amine - Cyclic ketone - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Ether - Organic oxoazanium - Azacycle - Organic nitrogen compound - Organic zwitterion - Carbonyl group - Organic oxygen compound - Organic oxide - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic salt - 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