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Substance Name: Pyrrolidine, 1,1'-(delta,delta'-nitriloditetramethylene)bis(gamma-isobutyl-gamma-(1-naphthyl)-
RN: 33310-57-5
InChIKey: RNIOMIKFOZKIOD-YTRKXGHFSA-N

Molecular Formula

  • C44-H59-N3

Molecular Weight

  • 629.971
 
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Names and Synonyms

Synonym

  • NSC 171419

Systematic Names

  • Pyrrolidine, 1,1'-(delta,delta'-nitriloditetramethylene)bis(gamma-isobutyl-gamma-(1-naphthyl)-
  • Pyrrolidine, 1-(5-methyl-3-(N-(4-methyl-2-(1-naphthyl)-2-(2-(1-pyrrolidinyl)ethyl)pentyl)formimidoyl)-3-(1-naphthyl)hexyl)- (8CI)

Registry Numbers

CAS Registry Number

  • 33310-57-5

System Generated Number

  • 0033310575

Structure Descriptors

InChI

1S/C44H59N3/c1-35(2)31-43(23-29-46-25-9-10-26-46,41-21-13-17-37-15-5-7-19-39(37)41)33-45-34-44(32-36(3)4,24-30-47-27-11-12-28-47)42-22-14-18-38-16-6-8-20-40(38)42/h5-8,13-22,33,35-36H,9-12,23-32,34H2,1-4H3/b45-33+

InChIKey

RNIOMIKFOZKIOD-YTRKXGHFSA-N

Smiles

c1([C@@](CC(C)C)(\C=N\C[C@@](c2c3c(cccc3)ccc2)(CC(C)C)CCN2CCCC2)CCN2CCCC2)c2c(cccc2)ccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 110mg/kg (110mg/kg)   Chimica Therapeutica. Vol. 6, Pg. 10, 1971.