Compound Identification
SMILES
COC1=CC=CC2=C1OC(=C2)C(=O)C1=C(O)C(=O)N(C1C1=CC(OC)=C(OC)C=C1)C1=NN=C(SCC2=CC=C(F)C=C2)S1
InChIKey
InChIKey=CLQDCDHXRBOYNB-UHFFFAOYSA-N
Formula
C31H24FN3O7S2
Mass
633.67
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
Dimethoxybenzenes Benzofurans Anisoles Aryl ketones Phenoxy compounds Pyrroline carboxylic acids and derivatives Alkylarylthioethers Fluorobenzenes Alkyl aryl ethers Aryl fluorides Heteroaromatic compounds Furans Thiadiazoles Vinylogous acids Tertiary carboxylic acid amides Pyrroles Lactams Sulfenyl compounds Enols Azacyclic compounds Oxacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - Dimethoxybenzene - O-dimethoxybenzene - Benzofuran - Pyrroline carboxylic acid or derivatives - Phenol ether - Aryl ketone - Phenoxy compound - Aryl thioether - Methoxybenzene - Anisole - Alkyl aryl ether - Alkylarylthioether - Fluorobenzene - Halobenzene - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Azole - Heteroaromatic compound - Furan - Vinylogous acid - Pyrrole - Thiadiazole - Tertiary carboxylic acid amide - Lactam - Ketone - Carboxamide group - Thioether - Sulfenyl compound - Oxacycle - Carboxylic acid derivative - Azacycle - Ether - Enol - Organic oxygen compound - Organic oxide - Carbonyl group - Organohalogen compound - Organooxygen compound - Organosulfur compound - Organofluoride - Organonitrogen compound - 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