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Substance Name: 2-(6-Bromo-1,3-benzodioxol-5-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)acrylic acid
RN: 94463-13-5
InChIKey: QOSHXRLIRSUBGX-LAFDYMOFSA-N

Molecular Formula

  • C17-H10-Br-N-O8

Molecular Weight

  • 436.169
 
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Names and Synonyms

Synonym

  • NSC 101649

Systematic Name

  • 2-(6-Bromo-1,3-benzodioxol-5-yl)-3-(6-nitro-1,3-benzodioxol-5-yl)acrylic acid

Registry Numbers

CAS Registry Number

  • 94463-13-5

System Generated Number

  • 0094463135

Structure Descriptors

InChI

1S/C17H10BrNO8/c18-11-4-15-14(25-7-26-15)3-9(11)10(17(20)21)1-8-2-13-16(27-6-24-13)5-12(8)19(22)23/h1-5H,6-7H2,(H,20,21)/b10-1-

InChIKey

QOSHXRLIRSUBGX-LAFDYMOFSA-N

Smiles

c1c(c(cc2c1OCO2)[N+](=O)[O-])/C=C(/c3cc4c(cc3Br)OCO4)\C(=O)O