Compound Identification
SMILES
CC(C)C1=C(C)C2=C(O)C(CC3=CC(=CC(CC4=CC(C(C)C)=C(C)C(CC5=C(O)C(C2)=CC(Cl)=C5C)=C4O)=C3O)[N+]([O-])=O)=C1
InChIKey
InChIKey=URXKDHRBDGSONI-UHFFFAOYSA-N
Formula
C37H40ClNO6
Mass
630.18
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Cumenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Cumenes
Intermediate Tree Nodes
Not available
Direct Parent
Cumenes
Alternative Parents
Nitroaromatic compounds Halophenols Aryl chlorides Propargyl-type 1,3-dipolar organic compounds Polyols Organic oxoazanium compounds Organonitrogen compounds Organochlorides Organic salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Cumene - Nitroaromatic compound - 4-halophenol - Phenol - Aryl chloride - Aryl halide - Organic nitro compound - C-nitro compound - Organic oxoazanium - Organic 1,3-dipolar compound - Polyol - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic salt - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic cation - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as cumenes. These are aromatic compounds containing a prop-2-ylbenzene moiety.
External Descriptors
Not available