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Substance Name: Benzo(a)pyren-7-ol, 6-nitro-, acetate (ester)
RN: 119087-37-5
InChIKey: OLSYDJUQRUQUFT-UHFFFAOYSA-N

Molecular Formula

  • C22-H13-N-O4

Molecular Weight

  • 355.348
 
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Names and Synonyms

Synonym

  • 6-Nitrobenzo(a)pyren-7-ol acetate (ester)

Systematic Name

  • Benzo(a)pyren-7-ol, 6-nitro-, acetate (ester)

Registry Numbers

CAS Registry Number

  • 119087-37-5

System Generated Number

  • 0119087375

Structure Descriptors

InChI

1S/C22H13NO4/c1-12(24)27-18-7-3-6-15-16-10-8-13-4-2-5-14-9-11-17(20(16)19(13)14)22(21(15)18)23(25)26/h2-11H,1H3

InChIKey

OLSYDJUQRUQUFT-UHFFFAOYSA-N

Smiles

C(C)(=O)Oc1cccc2c1c(c1ccc3cccc4ccc2c1c34)[N+](=O)[O-]