| SpectraBase Spectrum ID |
6d4ulrrPhXN |
| Name |
3-Thiophenecarboxylic acid, 5-(2-hydroxybenzoyl)-2-[(phenylmethyl)amino]-, phenylmethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
443.119129330 u |
| Formula |
C26H21NO4S |
| InChI |
InChI=1S/C26H21NO4S/c28-22-14-8-7-13-20(22)24(29)23-15-21(26(30)31-17-19-11-5-2-6-12-19)25(32-23)27-16-18-9-3-1-4-10-18/h1-15,27-28H,16-17H2 |
| InChIKey |
IQZXNTRIOQRLFH-UHFFFAOYSA-N |
| Molecular Weight |
443.517 g/mol |
| SMILES |
C1(O)=CC=CC=C1C(=O)C1=CC(C(=O)OCC2=CC=CC=C2)=C(NCC2=CC=CC=C2)S1 |
![3-Thiophenecarboxylic acid, 5-(2-hydroxybenzoyl)-2-[(phenylmethyl)amino]-, phenylmethyl ester](/api/spectrum/6d4ulrrPhXN/structure.png?h=300&w=458 "3-Thiophenecarboxylic acid, 5-(2-hydroxybenzoyl)-2-[(phenylmethyl)amino]-, phenylmethyl ester")
