Compound Identification
SMILES
CCOC(=O)C1=C(C)N=C(S1)N1C(C(C(=O)C2=CC3=C(O2)C(OC)=CC=C3)=C(O)C1=O)C1=CC(Cl)=C(Cl)C=C1
InChIKey
InChIKey=SHHRIMLBABUWRP-UHFFFAOYSA-N
Formula
C27H20Cl2N2O7S
Mass
587.42
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
Benzofurans Thiazolecarboxylic acids and derivatives Pyrroline carboxylic acids and derivatives 2,4,5-trisubstituted thiazoles Anisoles Aryl ketones Dichlorobenzenes Alkyl aryl ethers Aryl chlorides Vinylogous acids Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Furans Lactams Carboxylic acid esters Oxacyclic compounds Azacyclic compounds Enols Organic oxides Hydrocarbon derivatives Organonitrogen compounds Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - Benzofuran - 2,4,5-trisubstituted 1,3-thiazole - Anisole - 1,2-dichlorobenzene - Phenol ether - Aryl ketone - Pyrroline carboxylic acid or derivatives - Thiazolecarboxylic acid or derivatives - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous acid - Heteroaromatic compound - Azole - Furan - Pyrrole - Thiazole - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactam - Ketone - Carboxylic acid derivative - Azacycle - Oxacycle - Enol - Ether - Organohalogen compound - Organochloride - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - 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