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Substance Name: Serine, N-((2-chloroethyl)nitrosocarbamoyl)-, benzyl ester, L-
RN: 96409-01-7
InChIKey: JEYZBIHZVOVRTK-NSHDSACASA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H16-Cl-N3-O5

Molecular Weight

  • 329.7384
 
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Names and Synonyms

Synonyms

  • BRN 5613441
  • Ester benzylique de la N-(chloro-2 ethyl)-N-nitrosocarbamyl-L-serine
  • Ester benzylique de la N-(chloro-2 ethyl)-N-nitrosocarbamyl-L-serine [French]
  • L-Serine, N-(((2-chloroethyl)nitrosoamino)carbonyl)-, phenylmethyl ester
  • N-((2-Chloroethyl)nitrosocarbamoyl)-L-serine benzyl ester

Systematic Name

  • Serine, N-((2-chloroethyl)nitrosocarbamoyl)-, benzyl ester, L-

Registry Numbers

CAS Registry Number

  • 96409-01-7

System Generated Number

  • 0096409017

Structure Descriptors

InChI

1S/C13H16ClN3O5/c14-6-7-17(16-21)13(20)15-11(8-18)12(19)22-9-10-4-2-1-3-5-10/h1-5,11,18H,6-9H2,(H,15,20)/t11-/m0/s1

InChIKey

JEYZBIHZVOVRTK-NSHDSACASA-N

Smiles

C(=O)(N(N=O)CCCl)N[C@H](C(=O)OCc1ccccc1)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 110mg/kg (110mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 19, Pg. 512, 1984.