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Substance Name: Calcium 2-(((4-(((((oxidomethyl)amino)carbonyl)amino)sulphonyl)phenyl)amino)carbonyl)benzoate
RN: 97259-91-1
InChIKey: MPSSWSPZVSQBNX-UHFFFAOYSA-M

Molecular Formula

  • C16-H15-N3-O7-S.Ca

Molecular Weight

  • 431.4367
 
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Names and Synonyms

Synonym

  • EINECS 306-455-4

Systematic Name

  • Calcium 2-(((4-(((((oxidomethyl)amino)carbonyl)amino)sulphonyl)phenyl)amino)carbonyl)benzoate

Registry Numbers

CAS Registry Number

  • 97259-91-1

System Generated Number

  • 0097259911

Molecular Formulas

Molecular Formula

  • C16-H15-N3-O7-S.Ca

Molecular Formula Fragments

  • C16-H15-N3-O7-S
  • Ca
  • COMPONENT

Structure Descriptors

InChI

1S/C16H14N3O7S.Ca/c20-9-17-16(24)19-27(25,26)11-7-5-10(6-8-11)18-14(21)12-3-1-2-4-13(12)15(22)23;/h1-8H,9H2,(H,18,21)(H,22,23)(H2,17,19,24);/q-1;+2/p-1

InChIKey

MPSSWSPZVSQBNX-UHFFFAOYSA-M

Smiles

[Ca+2].C(c1c(cccc1)C(=O)Nc1ccc(cc1)S(=O)(=O)NC(=O)NC[O-])(=O)[O-]