Compound Identification
SMILES
N#CC1(C#N)C23C4C5=C6C7=C8C9=C%10C%11=C%12C%13=C%10C%10=C%14C%15=C%16C%17=C%18C%19=C%20C%21=C%22C%18=C%16C%16=C%14C%13=C%13C%16=C%22C%14=C%16C%13=C%12C%12=C%16C%13=C(C%16=C4C(=C69)C%11=C%12%16)C12C(C%13=C%21%14)=C%20C1=C3C5C2=C7C(=C%17C2=C%191)C%15=C8%10
InChIKey
InChIKey=GODIBLDBTXOENO-UHFFFAOYSA-N
Formula
C63H2N2
Mass
786.723
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenanthrenes and derivatives
- Subclass Triphenylenes
-
Class
Phenanthrenes and derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenanthrenes and derivatives
Subclass
Triphenylenes
Intermediate Tree Nodes
Not available
Direct Parent
Triphenylenes
Alternative Parents
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Triphenylene - Chrysene - Naphthalene - Nitrile - Carbonitrile - Organic nitrogen compound - Cyanide - Hydrocarbon derivative - Organonitrogen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as triphenylenes. These are compounds containing a triphenylene moiety, which consists of four fused benzene rings forming a 9,10-benzo[l]phenanthrene.
External Descriptors
Not available