Compound Identification
SMILES
[Na+].[Na+].CC(C)C1=CC=CC(C(C)C)=C1N1C(=O)C2=CC(OC3=CC=C(C=C3)S([O-])(=O)=O)=C3C4=CC=CC5=C(C=CC(C6=C(OC7=CC=C(C=C7)S([O-])(=O)=O)C=C(C1=O)C2=C36)=C45)C#CCCCCN=[N+]=[N-]
InChIKey
InChIKey=IFXHPYPMABGECL-UHFFFAOYSA-L
Formula
C52H40N4Na2O10S2
Mass
991.01
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenanthrenes and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Phenanthrenes and derivatives
Alternative Parents
Anthracenes Diarylethers Isoquinolones and derivatives Benzenesulfonic acids and derivatives 1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Phenylpropanes Cumenes Phenol ethers Phenoxy compounds Pyridinones Organosulfonic acids Sulfonyls Heteroaromatic compounds Azo compounds Azo imides Lactams Azacyclic compounds Organic oxides Organic sodium salts Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Anthracene - Phenanthrene - Diaryl ether - Isoquinolone - Isoquinoline - Benzenesulfonate - Arylsulfonic acid or derivatives - Cumene - Benzenesulfonyl group - Phenylpropane - 1-sulfo,2-unsubstituted aromatic compound - Phenoxy compound - Phenol ether - Pyridinone - Pyridine - Monocyclic benzene moiety - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Azo compound - Azo imide - Lactam - Organoheterocyclic compound - Organic alkali metal salt - Ether - Azacycle - Organic oxygen compound - Organic salt - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic sodium salt - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenanthrenes and derivatives. These are polycyclic compounds containing a phenanthrene moiety, which is a tricyclic aromatic compound with three non-linearly fused benzene.
External Descriptors
Not available