Compound Identification
SMILES
COC1=CC=C(C=C1)[C@H]1N(C[C@@H]2CCCO2)C(=O)C(O)=C1C(C)=O
InChIKey
InChIKey=KBGAOLYEZDMEMH-GOEBONIOSA-N
Formula
C18H21NO5
Mass
331.368
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
Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Vinylogous acids Tetrahydrofurans Tertiary carboxylic acid amides Pyrroles Ketones Lactams Oxacyclic compounds Azacyclic compounds Dialkyl ethers Enols Organopnictogen compounds Hydrocarbon derivatives Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrroline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Vinylogous acid - Tetrahydrofuran - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Ketone - Lactam - Carboxylic acid derivative - Dialkyl ether - Enol - Ether - Oxacycle - Azacycle - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxide - 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