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Substance Name: 2H-Benzimidazol-2-one, 1,3-dihydro-1-(1-(5-methyl-1,4-dioxaspiro(5.5)undec-3-ylmethyl)-4-piperidinyl)-, (E)-2-butenedioate
RN: 97306-32-6
InChIKey: UKBRROKAUFSSPR-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H33-N3-O3.x-C4-H4-O4

Molecular Weight

  • 515.6033
 
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Names and Synonyms

  • 2H-Benzimidazol-2-one, 1,3-dihydro-1-(1-(5-methyl-1,4-dioxaspiro(5.5)undec-3-ylmethyl)-4-piperidinyl)-, (E)-2-butenedioate

Registry Numbers

CAS Registry Number

  • 97306-32-6

System Generated Number

  • 0097306326

Molecular Formulas

Molecular Formula

  • C23-H33-N3-O3.x-C4-H4-O4

Molecular Formula Fragments

  • C23-H33-N3-O3
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C23H33N3O3.C4H4O4/c1-17-23(11-5-2-6-12-23)28-16-19(29-17)15-25-13-9-18(10-14-25)26-21-8-4-3-7-20(21)24-22(26)27;5-3(6)1-2-4(7)8/h3-4,7-8,17-19H,2,5-6,9-16H2,1H3,(H,24,27);1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

UKBRROKAUFSSPR-WLHGVMLRSA-N

Smiles

c1(=O)n(c2c([nH]1)cccc2)C1CCN(CC2OC(C3(OC2)CCCCC3)C)CC1.C(=O)(/C=C/C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 100mg/kg (100mg/kg)   French Demande Patent Document. Vol. #2547582,