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Substance Name: Butyronitrile, 2,2-diphenyl-4-(4-(3-hydroxymethyl-2-oxo-1-benzimidaizolinyl)piperidino)-
RN: 100700-38-7
InChIKey: HLBZVDQDHZUVOU-UHFFFAOYSA-N

Molecular Formula

  • C29-H30-N4-O2

Molecular Weight

  • 466.582
 
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Names and Synonyms

Synonyms

  • 1-(3-Cyano-3,3-diphenylpropyl)-4-(3-hydroxymethyl-2-oxo-1-benzimidazolinyl)-piperidine
  • 5-24-02-00380 (Beilstein Handbook Reference)
  • BRN 0869542

Systematic Name

  • Butyronitrile, 2,2-diphenyl-4-(4-(3-hydroxymethyl-2-oxo-1-benzimidaizolinyl)piperidino)-

Registry Numbers

CAS Registry Number

  • 100700-38-7

System Generated Number

  • 0100700387

Structure Descriptors

InChI

1S/C29H30N4O2/c30-21-29(23-9-3-1-4-10-23,24-11-5-2-6-12-24)17-20-31-18-15-25(16-19-31)33-27-14-8-7-13-26(27)32(22-34)28(33)35/h1-14,25,34H,15-20,22H2

InChIKey

HLBZVDQDHZUVOU-UHFFFAOYSA-N

Smiles

OCN1C(=O)N(C2CCN(CCC(C#N)(c3ccccc3)c4ccccc4)CC2)c5ccccc15

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 89mg/kg (89mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#12616,