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Substance Name: D-Xylopyranosylamine, N-(2-(1H-indol-3-yl)ethyl)-N-nitroso- (9CI)
RN: 111858-66-3
InChIKey: IHAFTOLIXGXSFD-PEUVFPKISA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C15-H19-N3-O5

Molecular Weight

  • 321.331
 
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Names and Synonyms

Synonyms

  • CCRIS 3640
  • N-(2-(3-Indolyl)ethyl)-N-nitroso-D-xylopyranosylamine
  • N-Nitroso-N-3-ethylindole-D-xylosylamine

Systematic Names

  • D-Xylopyranosylamine, N-(2-(1H-indol-3-yl)ethyl)-N-nitroso- (9CI)
  • D-Xylopyranosylamine, N-(2-(3-indolyl)ethyl)-N-nitroso-
  • N-Nitroso-N-3-ethylindole-D-xylosylamine

Registry Numbers

CAS Registry Number

  • 111858-66-3

System Generated Number

  • 0111858663

Structure Descriptors

InChI

1S/C15H19N3O5/c19-12-8-23-15(14(21)13(12)20)18(17-22)6-5-9-7-16-11-4-2-1-3-10(9)11/h1-4,7,12-16,19-21H,5-6,8H2/t12-,13+,14-,15?/m1/s1

InChIKey

IHAFTOLIXGXSFD-PEUVFPKISA-N

Smiles

N([C@@H]1[C@H](O)[C@@H](O)[C@H](O)CO1)(N=O)CCc1c[nH]c2ccccc12