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Substance Name: Carbamic acid, propionyl-, 2-sec-butyl-2-methyltrimethylene ester
RN: 25648-86-6
InChIKey: SBSJJTQFGARPQS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H28-N2-O6

Molecular Weight

  • 344.405
 
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Names and Synonyms

Synonyms

  • BRN 1890805
  • Propionylcarbamic acid 2-sec-butyl-2-methyltrimethylene ester

Systematic Name

  • Carbamic acid, propionyl-, 2-sec-butyl-2-methyltrimethylene ester

Registry Numbers

CAS Registry Number

  • 25648-86-6

System Generated Number

  • 0025648866

Structure Descriptors

InChI

1S/C16H28N2O6/c1-6-11(4)16(5,9-23-14(21)17-12(19)7-2)10-24-15(22)18-13(20)8-3/h11H,6-10H2,1-5H3,(H,17,19,21)(H,18,20,22)

InChIKey

SBSJJTQFGARPQS-UHFFFAOYSA-N

Smiles

C(C(COC(NC(=O)CC)=O)(C)[C@@H](CC)C)OC(NC(=O)CC)=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.