Compound Identification
SMILES
CCOC1=CC=C(C=C1)[C@H]1N(CCOCCO)C(=O)C(O)=C1C(=O)C1=CC=CO1
InChIKey
InChIKey=XYYJUPATKMBGDL-GOSISDBHSA-N
Formula
C21H23NO7
Mass
401.415
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyrrolines
- Subclass Phenylpyrrolines
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Class
Pyrrolines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolines
Subclass
Phenylpyrrolines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolines
Alternative Parents
Pyrroline carboxylic acids and derivatives Phenoxy compounds Phenol ethers Aryl ketones Alkyl aryl ethers Vinylogous acids Tertiary carboxylic acid amides Pyrroles Furans Heteroaromatic compounds Lactams Oxacyclic compounds Azacyclic compounds Dialkyl ethers Enols Primary alcohols Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrroline - Phenoxy compound - Aryl ketone - Pyrroline carboxylic acid or derivatives - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Furan - Heteroaromatic compound - Vinylogous acid - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Ketone - Lactam - Carboxylic acid derivative - Dialkyl ether - Enol - Ether - Oxacycle - Azacycle - Organic oxygen compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Primary alcohol - 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