Structure Information
Structure

Compound Identification

SMILES

COC(=O)CN(CC(CCN1CCC(CC1)C1=CC=CC=C1[S@](C)=O)C1=CC(Cl)=C(Cl)C=C1)C(O)C1=CC=CC2=CC=CC=C12

InChIKey

InChIKey=NEDFEYRJFAQYBM-ZPHVZSEHSA-N

Formula

C36H40Cl2N2O4S

Mass

667.69

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives - Alpha amino acids and derivatives

Direct Parent

Alpha amino acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid ester - Phenylpiperidine - Naphthalene - Phenyl sulfoxide - 1,2-dichlorobenzene - Aralkylamine - Halobenzene - Chlorobenzene - Benzenoid - Piperidine - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Methyl ester - Tertiary aliphatic amine - Tertiary amine - Sulfoxide - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Sulfinyl compound - Monocarboxylic acid or derivatives - Alkanolamine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Carbonyl group - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.

External Descriptors

Not available

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