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Substance Name: Benzoic acid, p-aminothio-, S-2-piperidinoethyl ester, phosphate
ID: DG33410000
InChIKey: XCCYTEOWLDEYMN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H20-N2-O-S.H3-O4-P

Molecular Weight

  • 362.3847
 
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Names and Synonyms

Synonym

  • p-Aminothiobenzoic acid S-2-piperidinoethyl ester phosphate

Systematic Name

  • Benzoic acid, p-aminothio-, S-2-piperidinoethyl ester, phosphate

Registry Numbers

ID Number

  • NIOSH/DG3341000

System Generated Number

  • DG33410000

Molecular Formulas

Molecular Formula

  • C14-H20-N2-O-S.H3-O4-P

Molecular Formula Fragments

  • C14-H20-N2-O-S
  • COMPONENT
  • H3-O4-P

Structure Descriptors

InChI

1S/C14H20N2OS.H3O4P/c15-13-6-4-12(5-7-13)14(17)18-11-10-16-8-2-1-3-9-16;1-5(2,3)4/h4-7H,1-3,8-11,15H2;(H3,1,2,3,4)

InChIKey

XCCYTEOWLDEYMN-UHFFFAOYSA-N

Smiles

Nc1ccc(cc1)C(=O)SCCN2CCCCC2.OP(=O)(O)O