Compound Identification
SMILES
COC1=C(O)C=CC(=C1)C1N(C(=O)C(O)=C1C(=O)C1=CC2=CC=CC=C2O1)C1=NN=C(SCC2=CC=CC=C2F)S1
InChIKey
InChIKey=ZXNNGAHIBUXYMA-UHFFFAOYSA-N
Formula
C29H20FN3O6S2
Mass
589.61
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 Benzofurans Aryl ketones Methoxybenzenes Anisoles Phenoxy compounds Pyrroline carboxylic acids and derivatives Alkyl aryl ethers Alkylarylthioethers Fluorobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl fluorides Furans Thiadiazoles Heteroaromatic compounds Pyrroles Vinylogous acids Tertiary carboxylic acid amides Lactams Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Enols Organic oxides Hydrocarbon derivatives Organonitrogen compounds Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - Methoxyphenol - Benzofuran - Pyrroline carboxylic acid or derivatives - Phenoxy compound - Aryl thioether - Anisole - Phenol ether - Aryl ketone - Methoxybenzene - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Alkylarylthioether - Fluorobenzene - Halobenzene - Monocyclic benzene moiety - Aryl fluoride - Aryl halide - Benzenoid - Azole - Heteroaromatic compound - Furan - Vinylogous acid - Thiadiazole - Tertiary carboxylic acid amide - Pyrrole - Lactam - Ketone - Carboxamide group - Thioether - Oxacycle - Sulfenyl compound - Carboxylic acid derivative - Azacycle - Ether - Enol - Organic oxygen compound - Organic oxide - Carbonyl group - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organofluoride - Hydrocarbon derivative - 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