Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC)C1N(CCC[N+]2=CNC=C2)C(=O)C([O-])=C1C(=O)C1=CC2=CC=CC=C2O1
InChIKey
InChIKey=XWJAPHQHFJVGNM-UHFFFAOYSA-N
Formula
C28H27N3O7
Mass
517.538
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
Benzofurans Anisoles Pyrroline carboxylic acids and derivatives Aryl ketones Phenoxy compounds Methoxybenzenes Alkyl aryl ethers N-substituted imidazoles Vinylogous acids Tertiary carboxylic acid amides Pyrroles Furans Heteroaromatic compounds Lactams Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organonitrogen compounds Organic zwitterions Organic oxides Organic salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - Benzofuran - Anisole - Phenol ether - Phenoxy compound - Pyrroline carboxylic acid or derivatives - Aryl ketone - Methoxybenzene - Alkyl aryl ether - N-substituted imidazole - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Furan - Imidazole - Vinylogous acid - Pyrrole - Azole - Tertiary carboxylic acid amide - Carboxamide group - Ketone - Lactam - Azacycle - Oxacycle - Carboxylic acid derivative - Ether - Organic salt - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organic zwitterion - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Aromatic heteropolycyclic 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