Dequalinium salicylate

CAS Registry Number®

16022-70-1

CAS Name

Dequalinium salicylate

Molecular Formula

C30H40N4.2C7H5O3

Cite this Page

Dequalinium salicylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=16022-70-1 (retrieved 2024-11-27) (CAS RN: 16022-70-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H38N4.C7H6O3/c1-23-21-27(31)25-15-9-11-17-29(25)33(23)19-13-7-5-3-4-6-8-14-20-34-24(2)22-28(32)26-16-10-12-18-30(26)34;8-6-4-2-1-3-5(6)7(9)10/h9-12,15-18,21-22,31-32H,3-8,13-14,19-20H2,1-2H3;1-4,8H,(H,9,10)/p+1

InChIKey

InChIKey=KIQDGIBPMHOGMD-UHFFFAOYSA-O

SMILES

C(CCCCCCCCC[N+]=1C2=C(C(N)=CC1C)C=CC=C2)[N+]=3C4=C(C(N)=CC3C)C=CC=C4.C([O-])(=O)C1=C(O)C=CC=C1

Canonical SMILES

O=C([O-])C=1C=CC=CC1O.NC1=CC(=[N+](C=2C=CC=CC12)CCCCCCCCCC[N+]=3C=4C=CC=CC4C(N)=CC3C)C

Other Names for this Substance

  • Quinolinium, 1,1′-(1,10-decanediyl)bis[4-amino-2-methyl-, 2-hydroxybenzoate (1:2)
  • Quinaldinium, 1,1′-decamethylenebis[4-amino-, disalicylate
  • Quinolinium, 1,1′-(1,10-decanediyl)bis[4-amino-2-methyl-, salt with 2-hydroxybenzoic acid (1:2)
  • Salicylic acid, ion(1-), 1,1′-decamethylenebis[4-aminoquinaldinium]
  • Benzoic acid, 2-hydroxy-, ion(1-), 1,1′-(1,10-decanediyl)bis[4-amino-2-methylquinolinium] (2:1)

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