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Substance Name: Benzoic acid, m-(2-phthalimidomethyl)-, compd. with 1-piperazineethanol (1:1)
ID: DH64762700
InChIKey: VMXAWSOXSINDDU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H11-N-O4.C6-H14-N2-O

Molecular Weight

  • 411.4555
 
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Names and Synonyms

Synonym

  • m-(2-Phthalimidomethyl)benzoic acid compd. with 1-piperazineethanol

Systematic Name

  • Benzoic acid, m-(2-phthalimidomethyl)-, compd. with 1-piperazineethanol (1:1)

Registry Numbers

ID Number

  • NIOSH/DH6476270

System Generated Number

  • DH64762700

Molecular Formulas

Molecular Formula

  • C16-H11-N-O4.C6-H14-N2-O

Molecular Formula Fragments

  • C16-H11-N-O4
  • C6-H14-N2-O
  • COMPONENT

Structure Descriptors

InChI

1S/C16H11NO4.C6H14N2O/c18-14-12-6-1-2-7-13(12)15(19)17(14)9-10-4-3-5-11(8-10)16(20)21;9-6-5-8-3-1-7-2-4-8/h1-8H,9H2,(H,20,21);7,9H,1-6H2

InChIKey

VMXAWSOXSINDDU-UHFFFAOYSA-N

Smiles

OCCN1CCNCC1.OC(=O)c2cccc(CN3C(=O)c4ccccc4C3=O)c2