3H-Indolium, 1,3,3-trimethyl-2-[2-(2-methyl-1H-indol-3-yl)ethenyl]-, sulfate (2:1)
CAS Registry Number®
41062-71-9
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CAS Name
3H-Indolium, 1,3,3-trimethyl-2-[2-(2-methyl-1H-indol-3-yl)ethenyl]-, sulfate (2:1)Molecular Formula
C22H23N2.1/2O4SCite this Page
3H-Indolium, 1,3,3-trimethyl-2-[2-(2-methyl-1H-indol-3-yl)ethenyl]-, sulfate (2:1). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=41062-71-9 (retrieved ) (CAS RN: 41062-71-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C22H22N2.H2O4S/c1-15-16(17-9-5-7-11-19(17)23-15)13-14-21-22(2,3)18-10-6-8-12-20(18)24(21)4;1-5(2,3)4/h5-14H,1-4H3;(H2,1,2,3,4)/p-1
InChIKey
InChIKey=MBYZGUOSPUUOCB-UHFFFAOYSA-M
SMILES
CC1(C)C=2C([N+](C)=C1C=CC=3C=4C(NC3C)=CC=CC4)=CC=CC2.S(=O)(=O)([O-])[O-]
Canonical SMILES
O=S(=O)([O-])[O-].C=1C=CC2=C(C1)NC(=C2C=CC3=[N+](C=4C=CC=CC4C3(C)C)C)C
Other Names for this Substance
- 3H-Indolium, 1,3,3-trimethyl-2-[2-(2-methyl-1H-indol-3-yl)ethenyl]-, sulfate (2:1)
- 1,3,3-Trimethyl-2-[2-(2-methyl-1H-indol-3-yl)ethenyl]-3H-indolium sulfate (2:1)
