Compound Identification
SMILES
CN(\N=C/C1=CC=C(O[P+]([S-])(OC2=CC=C(\C=N/N(C)[P+]([S-])(OC3=CC=C(\C=N/N(C)[P+]([S-])(OC4=CC=C(C=C4)C#N)OC4=CC=C(C=C4)C#N)C=C3)OC3=CC=C(\C=N/N(C)[P+]([S-])(OC4=CC=C(C=C4)C#N)OC4=CC=C(C=C4)C#N)C=C3)C=C2)N=P(C=C)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1)[P+]([S-])(OC1=CC=C(\C=N/N(C)[P+]([S-])(OC2=CC=C(C=C2)C#N)OC2=CC=C(C=C2)C#N)C=C1)OC1=CC=C(\C=N/N(C)[P+]([S-])(OC2=CC=C(C=C2)C#N)OC2=CC=C(C=C2)C#N)C=C1
InChIKey
InChIKey=MGMNUZUTDMEGSX-DHXBSMFPSA-N
Formula
C118H93N21O14P8S7
Mass
2501.39
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzonitriles
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzonitriles
Intermediate Tree Nodes
Not available
Direct Parent
Benzonitriles
Alternative Parents
Phenoxy compounds Nitriles Organophosphorus compounds Organooxygen compounds Organic zwitterions Organic salts Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenoxy compound - Benzonitrile - Nitrile - Carbonitrile - Organic nitrogen compound - Organic oxygen compound - Cyanide - Hydrocarbon derivative - Organic salt - Organic zwitterion - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.
External Descriptors
Not available