SpectraBase Spectrum ID |
BQGhVCEXSsA |
Name |
Methyl 1-[(4-Chlorobenzyl)amino]-5-methoxy-1H-indole-3-carboxylate Trifluoroacetate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H18ClF3N2O5 |
InChI |
InChI=1S/C18H17ClN2O3.C2HF3O2/c1-23-14-7-8-17-15(9-14)16(18(22)24-2)11-21(17)20-10-12-3-5-13(19)6-4-12;3-2(4,5)1(6)7/h3-9,11,20H,10H2,1-2H3;(H,6,7) |
InChIKey |
UKCFTOUMPMERAR-UHFFFAOYSA-N |
Molecular Weight |
458.821 g/mol |
SMILES |
OC(C(F)(F)F)=O.N([n]1cc(c2c1ccc(c2)OC)C(=O)OC)Cc1ccc(Cl)cc1 |
SPLASH |
splash10-014i-0393000000-bd205e2227272a034e4b |
Source of Spectrum |
U1-2008-5955-7c |
Wiley ID |
1662309 |