Compound Identification
SMILES
COC1=C(O)C=CC(=C1)C1N(CCCN2CCOCC2)C(=O)C(O)=C1C(=O)C1=CC=CS1
InChIKey
InChIKey=CFDKEYVWCKJKJI-UHFFFAOYSA-N
Formula
C23H26N2O6S
Mass
458.53
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
Methoxyphenols Anisoles Aryl ketones Methoxybenzenes Phenoxy compounds Pyrroline carboxylic acids and derivatives 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Morpholines Thiophenes Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Vinylogous acids Lactams Amino acids and derivatives Trialkylamines Oxacyclic compounds Enols Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrroline - Methoxyphenol - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Aryl ketone - Pyrroline carboxylic acid or derivatives - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Morpholine - Oxazinane - Benzenoid - Heteroaromatic compound - Vinylogous acid - Pyrrole - Thiophene - Tertiary carboxylic acid amide - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxamide group - Lactam - Ketone - Azacycle - Oxacycle - Carboxylic acid derivative - Ether - Enol - Dialkyl ether - Amine - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - 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