Compound Identification
SMILES
COC(=O)C1=C2C=CC3=C(C=C(C4=CN=CC=C4)C4=C3C2=C(C=C4)C(=C1)C1=CN=CC=C1)C(=O)OC
InChIKey
InChIKey=WWKJGMOKPMNSJM-UHFFFAOYSA-N
Formula
C30H20N2O4
Mass
472.5
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Pyrenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Pyrenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrenes
Alternative Parents
Phenanthrenes and derivatives Naphthalenecarboxylic acids Pyridines and derivatives Methyl esters Heteroaromatic compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrene - Phenanthrene - 2-naphthalenecarboxylic acid - 1-naphthalenecarboxylic acid or derivatives - 2-naphthalenecarboxylic acid or derivatives - Naphthalene - Pyridine - Methyl ester - Heteroaromatic compound - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrenes. These are compounds containing a pyrene moiety, which consists four fused benzene rings, resulting in a flat aromatic system.
External Descriptors
Not available