Compound Identification
SMILES
CC(C)C1=C(N2CCCCC2)C(C)=C2CC(C)(C)OC2=C1CCC1CC(O)CC(=O)O1
InChIKey
InChIKey=FDRGMYQXBGAPSK-UHFFFAOYSA-N
Formula
C26H39NO4
Mass
429.601
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
Coumarans Dialkylarylamines Delta valerolactones Alkyl aryl ethers Piperidines Oxanes Secondary alcohols Carboxylic acid esters Amino acids and derivatives Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cumene - Coumaran - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Alkyl aryl ether - Delta valerolactone - Delta_valerolactone - Oxane - Piperidine - Amino acid or derivatives - Carboxylic acid ester - Lactone - Secondary alcohol - Tertiary amine - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Alcohol - Aromatic heteropolycyclic 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