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Substance Name: Butanedioic acid, 2-sulfo-, 4-(2-((2-hydroxyethyl)(1-oxoisooctadecyl)amino)ethyl) ester, ammonium sodium salt (1:1:1)
RN: 72121-72-3
InChIKey: LDLMSYJXZVCIJJ-UHFFFAOYSA-M

Molecular Formula

  • C26-H49-N-O9-S.H3-N.Na

Molecular Weight

  • 590.7499
 
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Names and Synonyms

  • Butanedioic acid, 2-sulfo-, 4-(2-((2-hydroxyethyl)(1-oxoisooctadecyl)amino)ethyl) ester, ammonium sodium salt (1:1:1)
  • Butanedioic acid, sulfo-, 4-(2-((2-hydroxyethyl)(1-oxoisooctadecyl)amino)ethyl) ester, monoammonium monosodium salt

Registry Numbers

CAS Registry Number

  • 72121-72-3

System Generated Number

  • 0072121723

Molecular Formulas

Molecular Formula

  • C26-H49-N-O9-S.H3-N.Na

Molecular Formula Fragments

  • C26-H49-N-O9-S
  • COMPONENT
  • H3-N
  • Na

Structure Descriptors

InChI

1S/C26H49NO9S.H3N.Na/c1-22(2)15-13-11-9-7-5-3-4-6-8-10-12-14-16-24(29)27(17-19-28)18-20-36-25(30)21-23(26(31)32)37(33,34)35;;/h22-23,28H,3-21H2,1-2H3,(H,31,32)(H,33,34,35);1H3;/q;;+1/p-1

InChIKey

LDLMSYJXZVCIJJ-UHFFFAOYSA-M

Smiles

CC(C)CCCCCCCCCCCCCCC(=O)N(CCO)CCOC(=O)CC(C(=O)[O-])S(=O)(=O)[O-].[NH4+].[Na+]