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Substance Name: Carbamic acid, (1-((4-(2-(dimethylamino)ethoxy)phenyl)methyl)-2-(ethylamino)-2-oxoethyl)-, benzyl ester, oxalate, (S)-
RN: 57228-49-6
InChIKey: RETOBOSZYRWPLN-BOXHHOBZSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H31-N3-O4.C2-H2-O4

Molecular Weight

  • 503.549
 
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Names and Synonyms

Synonyms

  • CR 610
  • O-(2-Dimethylaminoethyl)-N-carbobenzoxy-L-tyrosyl-ethylamide oxalate

Systematic Name

  • Carbamic acid, (1-((4-(2-(dimethylamino)ethoxy)phenyl)methyl)-2-(ethylamino)-2-oxoethyl)-, benzyl ester, oxalate, (S)-

Registry Numbers

CAS Registry Number

  • 57228-49-6

System Generated Number

  • 0057228496

Molecular Formulas

Molecular Formula

  • C23-H31-N3-O4.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C23-H31-N3-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C23H31N3O4.C2H2O4/c1-4-24-22(27)21(25-23(28)30-17-19-8-6-5-7-9-19)16-18-10-12-20(13-11-18)29-15-14-26(2)3;3-1(4)2(5)6/h5-13,21H,4,14-17H2,1-3H3,(H,24,27)(H,25,28);(H,3,4)(H,5,6)/t21-;/m0./s1

InChIKey

RETOBOSZYRWPLN-BOXHHOBZSA-N

Smiles

c1(C[C@H](NC(OCc2ccccc2)=O)C(NCC)=O)ccc(OCC[NH+](C)C)cc1.C(C(=O)[O-])(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 139mg/kg (139mg/kg)   United States Patent Document. Vol. #4004008,