Structure Information
Structure

Compound Identification

SMILES

CC1=NC=C(N=C1)C(=O)N(CCCN1CCOCC1)CCC(=O)NCCC1=C(Cl)C=C(Cl)C=C1

InChIKey

InChIKey=SEZSLBNLQKDORO-UHFFFAOYSA-N

Formula

C24H31Cl2N5O3

Mass

508.44

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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

Direct Parent

Beta amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Beta amino acid or derivatives - Pyrazine carboxylic acid or derivatives - Pyrazinecarboxamide - 2-heteroaryl carboxamide - 1,3-dichlorobenzene - Halobenzene - Chlorobenzene - Morpholine - Aryl chloride - Oxazinane - Aryl halide - Monocyclic benzene moiety - Pyrazine - Benzenoid - Tertiary carboxylic acid amide - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Secondary carboxylic acid amide - Carboxamide group - Oxacycle - Azacycle - Dialkyl ether - Organoheterocyclic compound - Ether - Organic oxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organochloride - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.

External Descriptors

Not available

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