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Substance Name: Carbamic acid, benzyl-, 2-(hydroxymethyl)-2-methylpentyl ester, carbamate (ester)
RN: 25384-90-1
InChIKey: VUAHEQMBPKYXHB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H24-N2-O4

Molecular Weight

  • 308.376
 
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Names and Synonyms

Synonyms

  • 2-(Hydroxymethyl)-2-methylpentyl benzylcarbamate carbamate (ester)
  • Benzylcarbamic acid 2-(hydroxymethyl)-2-methylpentyl ester carbamate (ester)

Systematic Name

  • Carbamic acid, benzyl-, 2-(hydroxymethyl)-2-methylpentyl ester, carbamate (ester)

Registry Numbers

CAS Registry Number

  • 25384-90-1

System Generated Number

  • 0025384901

Structure Descriptors

InChI

1S/C16H24N2O4/c1-3-9-16(2,11-21-14(17)19)12-22-15(20)18-10-13-7-5-4-6-8-13/h4-8H,3,9-12H2,1-2H3,(H2,17,19)(H,18,20)

InChIKey

VUAHEQMBPKYXHB-UHFFFAOYSA-N

Smiles

C(N)(=O)OC[C@@](COC(NCc1ccccc1)=O)(CCC)C

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.