Benzenesulfonic acid, 2,6-difluoro-, 1-methyl-3-(1-methyl-4-piperidinyl)-1H-indol-5-yl ester, ethanedioate (1:1)
CAS Registry Number®
445441-27-0
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CAS Name
Benzenesulfonic acid, 2,6-difluoro-, 1-methyl-3-(1-methyl-4-piperidinyl)-1H-indol-5-yl ester, ethanedioate (1:1)Molecular Formula
C21H22F2N2O3S.C2H2O4Cite this Page
Benzenesulfonic acid, 2,6-difluoro-, 1-methyl-3-(1-methyl-4-piperidinyl)-1H-indol-5-yl ester, ethanedioate (1:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=445441-27-0 (retrieved ) (CAS RN: 445441-27-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C21H22F2N2O3S.C2H2O4/c1-24-10-8-14(9-11-24)17-13-25(2)20-7-6-15(12-16(17)20)28-29(26,27)21-18(22)4-3-5-19(21)23;3-1(4)2(5)6/h3-7,12-14H,8-11H2,1-2H3;(H,3,4)(H,5,6)
InChIKey
InChIKey=XQGFYENETWVJEU-UHFFFAOYSA-N
SMILES
CN1C=2C(C(=C1)C3CCN(C)CC3)=CC(OS(=O)(=O)C4=C(F)C=CC=C4F)=CC2.C(C(O)=O)(O)=O
Canonical SMILES
O=C(O)C(=O)O.O=S(=O)(OC=1C=CC2=C(C1)C(=CN2C)C3CCN(C)CC3)C=4C(F)=CC=CC4F
Other Names for this Substance
- Benzenesulfonic acid, 2,6-difluoro-, 1-methyl-3-(1-methyl-4-piperidinyl)-1H-indol-5-yl ester, ethanedioate (1:1)
- LY 483518
- SGS 518 oxalate
Deleted or Replaced CAS Registry Numbers
1000198-26-4