Febarbamate

CAS Registry Number®

13246-02-1

CAS Name

Febarbamate

Molecular Formula

C20H27N3O6

Molecular Mass

405.44

Cite this Page

Febarbamate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13246-02-1 (retrieved 2024-11-22) (CAS RN: 13246-02-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H27N3O6/c1-3-5-11-28-13-15(29-18(21)26)12-23-17(25)20(4-2,16(24)22-19(23)27)14-9-7-6-8-10-14/h6-10,15H,3-5,11-13H2,1-2H3,(H2,21,26)(H,22,24,27)

InChIKey

InChIKey=QHZQILHUJDRDAI-UHFFFAOYSA-N

SMILES

C(C)C1(C(=O)N(CC(COCCCC)OC(N)=O)C(=O)NC1=O)C2=CC=CC=C2

Canonical SMILES

O=C(OC(COCCCC)CN1C(=O)NC(=O)C(C1=O)(C=2C=CC=CC2)CC)N

Other Names for this Substance

  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-[2-[(aminocarbonyl)oxy]-3-butoxypropyl]-5-ethyl-5-phenyl-
  • Barbituric acid, 1-(3-butoxy-2-hydroxypropyl)-5-ethyl-5-phenyl-, carbamate (ester)
  • Carbamic acid, ester with 1-(3-butoxy-2-hydroxypropyl)-5-ethyl-5-phenylbarbituric acid
  • Barbituric acid, 1-(3-butoxy-2-hydroxypropyl)-5-ethyl-5-phenyl-, carbamate
  • 1-[2-[(Aminocarbonyl)oxy]-3-butoxypropyl]-5-ethyl-5-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione

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