SpectraBase Spectrum ID |
IpmqR4atkKy |
Name |
Propanedioic acid, 2-[[[2-(1H-pyrrol-1-yl)phenyl]amino]methylene]-, diethyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
328.142307128 u |
Formula |
C18H20N2O4 |
InChI |
InChI=1S/C18H20N2O4/c1-3-23-17(21)14(18(22)24-4-2)13-19-15-9-5-6-10-16(15)20-11-7-8-12-20/h5-13,19H,3-4H2,1-2H3 |
InChIKey |
CCWDOZNHWALXGS-UHFFFAOYSA-N |
Molecular Weight |
328.368 g/mol |
SMILES |
CCOC(=O)C(=CNC1=CC=CC=C1N1C=CC=C1)C(=O)OCC |