Structure Information
Structure

Compound Identification

SMILES

C[C@]12CCC3[C@@H](CCC4CNC(=O)CC[C@]34C)C1CC[C@@H]2OC(=O)CCCC1=CC=C(C=C1)N(CCCl)CCCl

InChIKey

InChIKey=HYLPWZVQLIFGBY-GCFFKVRXSA-N

Formula

C33H48Cl2N2O3

Mass

591.66

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactams

Subclass

Caprolactams

Intermediate Tree Nodes

Not available

Direct Parent

Caprolactams

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Nitrogen mustard - Caprolactam - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Azepane - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Tertiary amine - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Alkyl chloride - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - Aromatic heteropolycyclic 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

Previous Back Next