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Substance Name: Benzoic acid, p-(4-butyl-3,5-dioxopyrazolidine-1,2-diyl)bis-
ID: DG49235000
InChIKey: PTJYYSJTMWKBGK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H20-N2-O6

Molecular Weight

  • 396.397
 
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Names and Synonyms

Synonyms

  • 3,5-Pyrazolidinedione, 4-n-butyl-1,2-di(4'-carboxyphenyl)-
  • p-(4-Butyl-3,5-dioxopyrazolidine-1,2-diyl)bisbenzoic acid

Systematic Name

  • Benzoic acid, p-(4-butyl-3,5-dioxopyrazolidine-1,2-diyl)bis-

Registry Numbers

ID Number

  • NIOSH/DG4923500

System Generated Number

  • DG49235000

Structure Descriptors

InChI

1S/C21H20N2O6/c1-2-3-4-17-18(24)22(15-9-5-13(6-10-15)20(26)27)23(19(17)25)16-11-7-14(8-12-16)21(28)29/h5-12,17H,2-4H2,1H3,(H,26,27)(H,28,29)

InChIKey

PTJYYSJTMWKBGK-UHFFFAOYSA-N

Smiles

CCCCC1C(=O)N(N(C1=O)c2ccc(cc2)C(=O)O)c3ccc(cc3)C(=O)O