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Substance Name: Carbamic acid, isopropyl-, 2-(hydroxymethyl)-2-methylpentyl ester, propionylcarbamate (ester)
RN: 25648-91-3
InChIKey: BVNZMUMUOKCEIJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H28-N2-O5

Molecular Weight

  • 316.395
 
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Names and Synonyms

Synonyms

  • BRN 3061581
  • Isopropylcarbamic acid 2-(hydroxymethyl)-2-methylpentyl ester propionylcarbamate (ester)

Systematic Name

  • Carbamic acid, isopropyl-, 2-(hydroxymethyl)-2-methylpentyl ester, propionylcarbamate (ester)

Registry Numbers

CAS Registry Number

  • 25648-91-3

System Generated Number

  • 0025648913

Structure Descriptors

InChI

1S/C15H28N2O5/c1-6-8-15(5,10-22-13(19)16-11(3)4)9-17(14(20)21)12(18)7-2/h11H,6-10H2,1-5H3,(H,16,19)(H,20,21)

InChIKey

BVNZMUMUOKCEIJ-UHFFFAOYSA-N

Smiles

C(N(C(=O)CC)C[C@@](COC(NC(C)C)=O)(CCC)C)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1400mg/kg (1400mg/kg) AUTONOMIC NERVOUS SYSTEM: "SMOOTH MUSCLE RELAXANT (MECHANISM UNDEFINED, SPASMOLYTIC)" Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.