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Substance Name: Proline, 1-((2-chloroethyl)nitrosocarbamoyl)-4-hydroxy-, benzyl ester, L-
RN: 96409-04-0
InChIKey: OKOUAEQZKBOWRG-OLZOCXBDSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H18-Cl-N3-O5

Molecular Weight

  • 355.7762
 
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Names and Synonyms

Synonyms

  • 1-((2-Chloroethyl)nitrosocarbamoyl)-4-hydroxy-L-proline benzyl ester
  • BRN 5635731
  • Ester benzylique de la N-(chloro-2 ethyl)-N-nitrosocarbamyl-L-hydroxyproline
  • Ester benzylique de la N-(chloro-2 ethyl)-N-nitrosocarbamyl-L-hydroxyproline [French]
  • L-Proline, 1-(((2-chloroethyl)nitrosoamino)carbonyl)-4-hydroxy-, phenylmethyl ester, trans-

Systematic Name

  • Proline, 1-((2-chloroethyl)nitrosocarbamoyl)-4-hydroxy-, benzyl ester, L-

Registry Numbers

CAS Registry Number

  • 96409-04-0

System Generated Number

  • 0096409040

Structure Descriptors

InChI

1S/C15H18ClN3O5/c16-6-7-19(17-23)15(22)18-9-12(20)8-13(18)14(21)24-10-11-4-2-1-3-5-11/h1-5,12-13,20H,6-10H2/t12-,13+/m1/s1

InChIKey

OKOUAEQZKBOWRG-OLZOCXBDSA-N

Smiles

N1(C(=O)N(N=O)CCCl)[C@H](C(=O)OCc2ccccc2)C[C@H](C1)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 250mg/kg (250mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 19, Pg. 512, 1984.