Compound Identification
SMILES
CC1=CC=C(O1)C(=O)C1=C(O)C(=O)N(C1C1=CC(OCC2=CC=CC=C2)=CC=C1)C1=NC2=C(S1)C=C(Cl)C=C2
InChIKey
InChIKey=KGKTWHRFZZKZBG-UHFFFAOYSA-N
Formula
C30H21ClN2O5S
Mass
557.02
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
Benzothiazoles Pyrroline carboxylic acids and derivatives Phenoxy compounds Phenol ethers Aryl ketones Alkyl aryl ethers Aryl chlorides Vinylogous acids Thiazoles Tertiary carboxylic acid amides Pyrroles Furans Heteroaromatic compounds Lactams Oxacyclic compounds Azacyclic compounds Enols Organonitrogen compounds Organic oxides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - 1,3-benzothiazole - Phenoxy compound - Phenol ether - Pyrroline carboxylic acid or derivatives - Aryl ketone - Alkyl aryl ether - Aryl chloride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Thiazole - Tertiary carboxylic acid amide - Azole - Pyrrole - Furan - Heteroaromatic compound - Vinylogous acid - Ketone - Lactam - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Enol - Ether - Organic oxygen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen 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