Compound Identification
SMILES
COC1=CC=CC2=C1OC(=C2)C(=O)C1=C(O)C(=O)N(C1C1=CC=C(C=C1)[N+]([O-])=O)C1=NN=C(SCC2=CC=CC=C2)S1
InChIKey
InChIKey=SCTIJQOGIMXVSN-UHFFFAOYSA-N
Formula
C29H20N4O7S2
Mass
600.62
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
Benzofurans Nitrobenzenes Pyrroline carboxylic acids and derivatives Anisoles Aryl ketones Nitroaromatic compounds Alkyl aryl ethers Alkylarylthioethers Vinylogous acids Thiadiazoles Tertiary carboxylic acid amides Pyrroles Furans Heteroaromatic compounds Lactams Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Enols Organic oxoazanium compounds Organonitrogen compounds Organic salts Organic zwitterions Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - Benzofuran - Nitrobenzene - Anisole - Aryl thioether - Nitroaromatic compound - Phenol ether - Pyrroline carboxylic acid or derivatives - Aryl ketone - Alkyl aryl ether - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Vinylogous acid - Azole - Furan - Thiadiazole - Tertiary carboxylic acid amide - Heteroaromatic compound - Pyrrole - Organic nitro compound - Carboxamide group - Ketone - Lactam - C-nitro compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Enol - Ether - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Thioether - Organic oxoazanium - Oxacycle - Carbonyl group - Organic zwitterion - Organic salt - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxygen 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