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Substance Name: 4-Nitro-N-(5-nitro-1-(4-nitrobenzoyl)-2,1-benzisothiazol-3(1H)-ylidene)benzamide
RN: 106532-78-9
InChIKey: WMJVWLNDLKRREM-XDOYNYLZSA-N

Molecular Weight

  • 493.4109
 
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Names and Synonyms

Synonym

  • CCRIS 5027

Systematic Name

  • 4-Nitro-N-(5-nitro-1-(4-nitrobenzoyl)-2,1-benzisothiazol-3(1H)-ylidene)benzamide

Registry Numbers

CAS Registry Number

  • 106532-78-9

System Generated Number

  • 0106532789

Structure Descriptors

InChI

1S/C21H11N5O8S/c27-19(12-1-5-14(6-2-12)24(29)30)22-20-17-11-16(26(33)34)9-10-18(17)23(35-20)21(28)13-3-7-15(8-4-13)25(31)32/h1-11H/b22-20-

InChIKey

WMJVWLNDLKRREM-XDOYNYLZSA-N

Smiles

[O-][N+](=O)c1ccc(cc1)C(=O)\N=C\2/SN(C(=O)c3ccc(cc3)[N+](=O)[O-])c4ccc(cc24)[N+](=O)[O-]