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Substance Name: Benzo(e)pyrene, 9,10,11,12-tetrahydro-4-nitro-
RN: 134998-79-1
InChIKey: IPLPTZVDWUUJQN-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C20-H15-N-O2

Molecular Weight

  • 301.344
 
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Names and Synonyms

Synonyms

  • 4-Nitro-9,10,11,12-tetrahydrobenzo(e)pyrene
  • CCRIS 8057

Systematic Names

  • 4-Nitro-9,10,11,12-tetrahydrobenzo(e)pyrene
  • Benzo(e)pyrene, 9,10,11,12-tetrahydro-4-nitro-

Registry Numbers

CAS Registry Number

  • 134998-79-1

System Generated Number

  • 0134998791

Structure Descriptors

InChI

1S/C20H15NO2/c22-21(23)18-11-12-5-3-8-15-13-6-1-2-7-14(13)16-9-4-10-17(18)20(16)19(12)15/h3-5,8-11H,1-2,6-7H2

InChIKey

IPLPTZVDWUUJQN-UHFFFAOYSA-N

Smiles

c1ccc2c3c(c4cccc5cc(c1c2c45)[N+](=O)[O-])CCCC3