Compound Identification
SMILES
COC1=CC=C(C=C1)C1N(C2=NC=C(S2)S(=O)(=O)C2=CC=C(C=C2)[N+]([O-])=O)C(=O)C(=O)\C1=C(\O)C1=CC=C(C)C=C1
InChIKey
InChIKey=YYPIPOVKPWAXLM-WJTDDFOZSA-N
Formula
C28H21N3O8S2
Mass
591.61
Taxonomic Classification
Taxonomy Tree
-
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 Benzenesulfonyl compounds Methoxybenzenes Nitroaromatic compounds Anisoles Phenoxy compounds Toluenes Alkyl aryl ethers 2,5-disubstituted thiazoles Pyrrolidine-3-ones Pyrrolidine-2-ones Heteroaromatic compounds Sulfones Tertiary carboxylic acid amides Vinylogous acids Pyrroles Lactams Cyclic ketones Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Enols Organic salts Organic zwitterions Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Benzenesulfonyl group - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Anisole - Phenol ether - Methoxybenzene - 2,5-disubstituted 1,3-thiazole - Alkyl aryl ether - Toluene - 3-pyrrolidone - 2-pyrrolidone - Benzenoid - Pyrrolidone - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Sulfonyl - Sulfone - Thiazole - Pyrrole - Heteroaromatic compound - Azole - Vinylogous acid - Carboxamide group - Ketone - Lactam - C-nitro compound - Organic nitro compound - Cyclic ketone - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Enol - Ether - Organic oxoazanium - Carbonyl group - Organic salt - Organic zwitterion - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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