Denatonium saccharide
CAS Registry Number®
90823-38-4
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CAS Name
Denatonium saccharideMolecular Formula
C21H29N2O.C7H4NO3SCite this Page
Denatonium saccharide. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=90823-38-4 (retrieved ) (CAS RN: 90823-38-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C21H28N2O.C7H5NO3S/c1-5-23(6-2,15-19-13-8-7-9-14-19)16-20(24)22-21-17(3)11-10-12-18(21)4;9-7-5-3-1-2-4-6(5)12(10,11)8-7/h7-14H,5-6,15-16H2,1-4H3;1-4H,(H,8,9)
InChIKey
InChIKey=AOVWCKBXCSVODH-UHFFFAOYSA-N
SMILES
[N+](CC1=CC=CC=C1)(CC(NC2=C(C)C=CC=C2C)=O)(CC)CC.O=S1(=O)C=2C(C(=O)[N-]1)=CC=CC2
Canonical SMILES
O=C1[N-]S(=O)(=O)C=2C=CC=CC12.O=C(NC=1C(=CC=CC1C)C)C[N+](CC=2C=CC=CC2)(CC)CC
Other Names for this Substance
- Benzenemethanaminium, N-[2-[(2,6-dimethylphenyl)amino]-2-oxoethyl]-N,N-diethyl-, salt with 1,2-benzisothiazol-3(2H)-one 1,1-dioxide (1:1)
- 1,2-Benzisothiazol-3(2H)-one, 1,1-dioxide, ion(1-), N-[2-[(2,6-dimethylphenyl)amino]-2-oxoethyl]-N,N-diethylbenzenemethanaminium
- Denatonium saccharide
- Ro-Pel
- Super Vilex
Deleted or Replaced CAS Registry Numbers
103735-41-7
