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Substance Name: 1,2-Anthracenediol, 1,2-dihydro-7-nitro-, (1-alpha,2-beta)-
ID: CA97450000
InChIKey: YBKLCCBQPCUDIE-KBPBESRZSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C14-H11-N-O4

Molecular Weight

  • 257.2439
 
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Names and Synonyms

Synonyms

  • (1-alpha,2-beta)-1,2-Dihydro-7-nitro-1,2-anthracenediol
  • 2-Nitroanthracene trans-7,8-dihydrodiol
  • trans-7,8-Dihydroxy-2-nitro-7,8-dihydroanthracene

Systematic Name

  • 1,2-Anthracenediol, 1,2-dihydro-7-nitro-, (1-alpha,2-beta)-

Registry Numbers

ID Number

  • NIOSH/CA9745000

System Generated Number

  • CA97450000

Structure Descriptors

InChI

1S/C14H11NO4/c16-13-4-2-9-5-8-1-3-11(15(18)19)6-10(8)7-12(9)14(13)17/h1-7,13-14,16-17H/t13-,14-/m0/s1

InChIKey

YBKLCCBQPCUDIE-KBPBESRZSA-N

Smiles

c1c(ccc2cc3C=C[C@@H]([C@H](c3cc12)O)O)[N+](=O)[O-]