Pyridinium, 3-[(diethylamino)carbonyl]-1-methyl-, 4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-2-sulfonate (1:1)

CAS Registry Number®

4876-45-3

CAS Name

Pyridinium, 3-[(diethylamino)carbonyl]-1-methyl-, 4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-2-sulfonate (1:1)

Molecular Formula

C11H17N2O.C10H15O4S

Molecular Mass

424.56

Cite this Page

Pyridinium, 3-[(diethylamino)carbonyl]-1-methyl-, 4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-2-sulfonate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4876-45-3 (retrieved 2025-04-21) (CAS RN: 4876-45-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    174-175 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C11H17N2O.C10H16O4S/c1-4-13(5-2)11(14)10-7-6-8-12(3)9-10;1-9(2)6-4-5-10(9,3)8(11)7(6)15(12,13)14/h6-9H,4-5H2,1-3H3;6-7H,4-5H2,1-3H3,(H,12,13,14)/q+1;/p-1

InChIKey

InChIKey=QPHACUMLBDXKIF-UHFFFAOYSA-M

SMILES

CC12C(C)(C)C(C(S(=O)(=O)[O-])C1=O)CC2.C(N(CC)CC)(=O)C1=C[N+](C)=CC=C1

Canonical SMILES

O=C(C1=CC=C[N+](=C1)C)N(CC)CC.O=C1C(C2CCC1(C)C2(C)C)S(=O)(=O)[O-]

Other Names for this Substance

  • Pyridinium, 3-[(diethylamino)carbonyl]-1-methyl-, 4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-2-sulfonate (1:1)
  • Pyridinium, 3-(diethylcarbamoyl)-1-methyl-, 2-oxo-3-bornanesulfonate
  • Pyridinium, 3-[(diethylamino)carbonyl]-1-methyl-, salt with 4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-2-sulfonic acid (1:1)
  • 3-(Diethylcarbamoyl)-1-methylpyridinium 2-oxo-3-bornanesulfonate
  • 3-Bornanesulfonic acid, 2-oxo-, 3-(diethylcarbamoyl)-1-methylpyridinium salt

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CAS INSIGHTSTM
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