SpectraBase Spectrum ID |
J9LHTyCqMTZ |
Name |
2-(2-Thienyl)-4-quinolinecarboxylic acid compound with 4-ethoxyaniline (1:1) |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
392.119463683 u |
Formula |
C22H20N2O3S |
InChI |
InChI=1S/C14H9NO2S.C8H11NO/c16-14(17)10-8-12(13-6-3-7-18-13)15-11-5-2-1-4-9(10)11;1-2-10-8-5-3-7(9)4-6-8/h1-8H,(H,16,17);3-6H,2,9H2,1H3 |
InChIKey |
TYKXNMKGPZBFRU-UHFFFAOYSA-N |
Molecular Weight |
392.473 g/mol |
SMILES |
NC=1C=CC(=CC1)OCC.OC(C=1C=C(C=2SC=CC2)N=C2C1C=CC=C2)=O |