Compound Identification
SMILES
[Cl-].[Ni++].CC1=CC=C(C=C1)C1=C2[N-]C(C=C2)=C(C2=CC=C(O2)C2=NC(C=C2)=C(C2=CC=C1O2)C1=CC=C(C)C=C1)C1=CC=CC=C1
InChIKey
InChIKey=DDJNHFSQHCSUKN-UHFFFAOYSA-M
Formula
C39H27ClN2NiO2
Mass
649.8
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Toluenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Not available
Direct Parent
Toluenes
Alternative Parents
Pyrroles Heteroaromatic compounds Furans Oxacyclic compounds Organic transition metal salts Organic metal halides Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic zwitterions Organic chloride salts Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Toluene - Furan - Pyrrole - Heteroaromatic compound - Oxacycle - Azacycle - Organic transition metal salt - Organoheterocyclic compound - Organic metal halide - Hydrocarbon derivative - Organonitrogen compound - Organic chloride salt - Organic salt - Organic zwitterion - Organic nitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as toluenes. These are compounds containing a benzene ring which bears a methane group.
External Descriptors
Not available