Compound Identification
SMILES
CCOC1=C(OCC)C=C(C=C1)C1N(C(=O)C(O)=C1C(=O)C1=CC=C(C)O1)C1=NC(C)=C(S1)C(=O)OCC=C
InChIKey
InChIKey=CEIBOVDFZLMJDW-UHFFFAOYSA-N
Formula
C28H28N2O8S
Mass
552.6
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolines
- Subclass Phenylpyrrolines
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Class
Pyrrolines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolines
Subclass
Phenylpyrrolines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolines
Alternative Parents
Thiazolecarboxylic acids and derivatives Pyrroline carboxylic acids and derivatives Phenoxy compounds Phenol ethers 2,4,5-trisubstituted thiazoles Aryl ketones Alkyl aryl ethers Vinylogous acids Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Furans Lactams Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Enols Organonitrogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrroline - 2,4,5-trisubstituted 1,3-thiazole - Phenoxy compound - Phenol ether - Pyrroline carboxylic acid or derivatives - Thiazolecarboxylic acid or derivatives - Aryl ketone - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Azole - Furan - Heteroaromatic compound - Pyrrole - Tertiary carboxylic acid amide - Thiazole - Vinylogous acid - Carboxamide group - Carboxylic acid ester - Ketone - Lactam - Azacycle - Ether - Enol - Carboxylic acid derivative - Oxacycle - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrrolines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrroline ring through a CC or CN bond.
External Descriptors
Not available