Compound Identification
SMILES
CCOC1=C(OCCC(C)C)C=CC(=C1)C1N(C(=O)C(=O)\C1=C(\O)C1=CC2=C(OCCO2)C=C1)C1=NC=CS1
InChIKey
InChIKey=VBNCHFFQXFLMET-SHHOIMCASA-N
Formula
C29H30N2O7S
Mass
550.63
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
Benzo-1,4-dioxanes Phenol ethers Phenoxy compounds Alkyl aryl ethers Para dioxins Pyrrolidine-3-ones Pyrrolidine-2-ones Vinylogous acids Thiazoles Heteroaromatic compounds Tertiary carboxylic acid amides Pyrroles Lactams Cyclic ketones Azacyclic compounds Oxacyclic compounds Enols Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Benzo-1,4-dioxane - Benzodioxane - Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Para-dioxin - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Benzenoid - Tertiary carboxylic acid amide - Vinylogous acid - Thiazole - Azole - Pyrrole - Heteroaromatic compound - Cyclic ketone - Carboxamide group - Ketone - Lactam - Ether - Enol - Carboxylic acid derivative - Azacycle - Oxacycle - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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