Compound Identification
SMILES
COC1=CC=C(CCNC(=O)N[C@@H](CN2CCCCCC2=O)C2=CC=CC=C2)C=C1
InChIKey
InChIKey=CYEJKOYFXBGBFN-QFIPXVFZSA-N
Formula
C24H31N3O3
Mass
409.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
- Subclass Caprolactams
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Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Caprolactams
Intermediate Tree Nodes
Not available
Direct Parent
Caprolactams
Alternative Parents
Phenoxy compounds Methoxybenzenes Anisoles Azepanes Alkyl aryl ethers Tertiary carboxylic acid amides Ureas Tertiary amines Amino acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Anisole - Caprolactam - Phenol ether - Methoxybenzene - Alkyl aryl ether - Azepane - Monocyclic benzene moiety - Benzenoid - Tertiary carboxylic acid amide - Tertiary amine - Urea - Amino acid or derivatives - Carboxamide group - Azacycle - Ether - Carboxylic acid derivative - Amine - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as caprolactams. These are cyclic amides of caproic acid. Caproic acid is the carboxylic acid derived from hexane with the general formula C5H11COOH.
External Descriptors
Not available