Compound Identification
SMILES
CC1=CC(C)=C2N=C(SC2=C1)N1[C@H](C(C(=O)C2=CC=CO2)=C(O)C1=O)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=IFOVDBTUQBZZSQ-FQEVSTJZSA-N
Formula
C24H17N3O6S
Mass
475.48
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolines
- Subclass Phenylpyrrolines
-
Class
Pyrrolines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolines
Subclass
Phenylpyrrolines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolines
Alternative Parents
Benzothiazoles Nitrobenzenes Pyrroline carboxylic acids and derivatives Aryl ketones Nitroaromatic compounds Vinylogous acids Thiazoles Tertiary carboxylic acid amides Pyrroles Furans Heteroaromatic compounds Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Oxacyclic compounds Enols Organic oxoazanium compounds Organic zwitterions Hydrocarbon derivatives Organic salts Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrroline - 1,3-benzothiazole - Nitrobenzene - Nitroaromatic compound - Pyrroline carboxylic acid or derivatives - Aryl ketone - Monocyclic benzene moiety - Benzenoid - Azole - Furan - Pyrrole - Heteroaromatic compound - Tertiary carboxylic acid amide - Thiazole - Vinylogous acid - Organic nitro compound - Ketone - Carboxamide group - Lactam - C-nitro compound - Oxacycle - Carboxylic acid derivative - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Enol - Organic oxoazanium - Organic zwitterion - Carbonyl group - Organic oxygen compound - Organic oxide - Organic salt - Organonitrogen compound - Organooxygen 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