Compound Identification
SMILES
CCOC(=O)CC(O)CC(O)CCC1=C2OC(C)(C)CC2=C(C)C(NCC2=CC=CC=C2)=C1C(C)C
InChIKey
InChIKey=YCPYGHNINCOPGV-UHFFFAOYSA-N
Formula
C30H43NO5
Mass
497.676
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 Benzylamines Phenylmethylamines Alkyl aryl ethers Aralkylamines Secondary alkylarylamines Beta hydroxy acids and derivatives Fatty acid esters Secondary alcohols Carboxylic acid esters Amino acids and derivatives Monocarboxylic acids and derivatives Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cumene - Coumaran - Benzylamine - Phenylmethylamine - Alkyl aryl ether - Beta-hydroxy acid - Fatty acid ester - Aralkylamine - Secondary aliphatic/aromatic amine - Fatty acyl - Hydroxy acid - Amino acid or derivatives - Carboxylic acid ester - Secondary alcohol - Ether - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Secondary amine - Oxacycle - Alcohol - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organic nitrogen compound - 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