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Substance Name: L-Proline, 1-((4-chlorophenyl)methyl)-5-oxo-, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1)
RN: 59749-44-9
InChIKey: AXEOLLIOXRANOZ-KZHAMYRLSA-N

Molecular Formula

  • C16-H21-Cl-N2-O3.C4-H4-O4

Molecular Weight

  • 440.8775
 
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Names and Synonyms

Synonyms

  • Maleate de N-(p-chlorobenzyl)pyroglutamate de dimethylaminoethyle
  • Maleate de N-(p-chlorobenzyl)pyroglutamate de dimethylaminoethyle [French]

Systematic Name

  • L-Proline, 1-((4-chlorophenyl)methyl)-5-oxo-, 2-(dimethylamino)ethyl ester, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 59749-44-9

System Generated Number

  • 0059749449

Molecular Formulas

Molecular Formula

  • C16-H21-Cl-N2-O3.C4-H4-O4

Molecular Formula Fragments

  • C16-H21-Cl-N2-O3
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C16H21ClN2O3.C4H4O4/c1-18(2)9-10-22-16(21)14-7-8-15(20)19(14)11-12-3-5-13(17)6-4-12;5-3(6)1-2-4(7)8/h3-6,14H,7-11H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t14-;/m0./s1

InChIKey

AXEOLLIOXRANOZ-KZHAMYRLSA-N

Smiles

CN(C)CCOC(=O)[C@@H]1CCC(=O)N1Cc2ccc(cc2)Cl.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1200mg/kg (1200mg/kg)   French Demande Patent Document. Vol. #2273533,