Compound Identification
SMILES
[Ti+4].[CH-]1[C-]=[C-][C-]=[C-]1.CC1=CC=C([N-]C2=C(NC3=C2C=C(C)C=C3)C2(C)CC([N-]C3=CC=C(C)C=C3)=C(CC(C)=C2)[N-]C2=CC=C(C)C=C2)C=C1
InChIKey
InChIKey=ULRYXQPYEIKUCW-UHFFFAOYSA-N
Formula
C44H40N4Ti
Mass
672.701
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
- Subclass Indoles
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
Indoles
Alternative Parents
Toluenes Substituted pyrroles Heteroaromatic compounds Aromatic hydrocarbons Organic transition metal salts Carbene-type 1,3-dipolar compounds Azacyclic compounds Unsaturated hydrocarbons Organonitrogen compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
Indole - Toluene - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - Aromatic hydrocarbon - Pyrrole - Heteroaromatic compound - Azacycle - Organic transition metal salt - Carbene-type 1,3-dipolar compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Unsaturated hydrocarbon - Organic salt - Organic cation - Hydrocarbon - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole.
External Descriptors
Not available