Structure Information
Structure

Compound Identification

SMILES

CC1=CC(C2=CC=CC=C2C(F)(F)F)C(C(=O)OCCNC(=O)C2N(CCC2=O)C2=CC(I)=C(O)C=C2)=C(C)N1

InChIKey

InChIKey=LLXOATMJZSVSII-UHFFFAOYSA-N

Formula

C28H27F3IN3O5

Mass

669.44

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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 - Alpha amino acids and derivatives

Direct Parent

Proline and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Proline or derivatives - Alpha-amino acid amide - 1-phenylpyrrolidine - Trifluoromethylbenzene - Dihydropyridinecarboxylic acid derivative - P-aminophenol - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Pyrrolidine-2-carboxamide - Pyrrolidine carboxylic acid or derivatives - 2-iodophenol - 2-halophenol - Aminophenol - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Iodobenzene - Halobenzene - Fatty acid ester - Dihydropyridine - Fatty acyl - Benzenoid - 1,3-dicarbonyl compound - 3-pyrrolidone - Pyrrolidone - N-acyl-amine - Hydropyridine - Fatty amide - Beta-aminoketone - Monocyclic benzene moiety - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Pyrrolidine - Pyrrole - Alpha-aminoketone - Cyclic ketone - Tertiary aliphatic amine - Tertiary amine - Ketone - Carboxylic acid ester - Carboxamide group - Azacycle - Iodoalkene - Haloalkene - Organoheterocyclic compound - Vinyl iodide - Vinyl halide - Secondary amine - Monocarboxylic acid or derivatives - Enamine - Secondary aliphatic amine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organoiodide - Organofluoride - Organohalogen compound - Amine - Alkyl halide - Alkyl fluoride - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as proline and derivatives. These are compounds containing proline or a derivative thereof resulting from reaction of proline at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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