Compound Identification
SMILES
O=C1C2=CC=CC=C2C(=O)C2=C1C=CC=C2NC1=C2C3=C(NC4=CC=CC5=C4C(=O)C4=CC=CC=C4C5=O)C=C4C5=CC=CC=C5C(=O)C5=C4C3=C(C=C5)C3=C2C2=C(C=C3)C(=O)C3=CC=CC=C3C2=C1
InChIKey
InChIKey=UGSQFDNHGAUKMD-UHFFFAOYSA-N
Formula
C62H30N2O6
Mass
898.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Pyrenes
- Subclass Benzopyrenes
-
Class
Pyrenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Pyrenes
Subclass
Benzopyrenes
Intermediate Tree Nodes
Not available
Direct Parent
Benzopyrenes
Alternative Parents
Chrysenes Anthraquinones Aryl ketones Primary aromatic amines Vinylogous amides Secondary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Benzo-a-pyrene - Chrysene - 9,10-anthraquinone - Anthraquinone - Anthracene - Phenanthrene - Aryl ketone - Primary aromatic amine - Vinylogous amide - Ketone - Secondary amine - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzopyrenes. These are organic compounds containing a benzene fused to a pyrene(benzo[def]phenanthrene) ring system.
External Descriptors
Not available