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Substance Name: 8-Nitro benzo(E)pyren-3-ol
RN: 115664-50-1
UNII: W5618489DE
InChIKey: RFVBTMAHKTUIBO-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C20-H11-N-O3

Molecular Weight

  • 313.311
 
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Names and Synonyms

Name of Substance

  • 8-Nitro benzo(E)pyren-3-ol

Synonyms

  • 1-Nitrobenzo(e)pyren-6-ol
  • 6-Hydroxy-1-nitrobenzo(e)pyrene
  • CCRIS 1531
  • UNII-W5618489DE

Systematic Names

  • 6-Hydroxy-1-nitrobenzo(e)pyrene
  • Benzo(e)pyren-3-ol, 8-nitro-

Registry Numbers

CAS Registry Number

  • 115664-50-1

FDA UNII

  • W5618489DE

System Generated Number

  • 0115664501

Structure Descriptors

InChI

1S/C20H11NO3/c22-17-10-8-14-12-3-1-2-4-13(12)20-16(21(23)24)9-6-11-5-7-15(17)19(14)18(11)20/h1-10,22H

InChIKey

RFVBTMAHKTUIBO-UHFFFAOYSA-N

Smiles

c1(ccc2c3c(c4c(ccc5ccc1c2c45)[N+](=O)[O-])cccc3)O