| SpectraBase Spectrum ID |
9DrF95QAKfo |
| Name |
Benzoic acid, 2-[[2-[(2-hydroxy-2-phenylethyl)amino]-1,2-dioxoethyl]amino]-4,5-dimethoxy-, methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
402.142701049 u |
| Formula |
C20H22N2O7 |
| InChI |
InChI=1S/C20H22N2O7/c1-27-16-9-13(20(26)29-3)14(10-17(16)28-2)22-19(25)18(24)21-11-15(23)12-7-5-4-6-8-12/h4-10,15,23H,11H2,1-3H3,(H,21,24)(H,22,25) |
| InChIKey |
MVQYHPMGHQKVPS-UHFFFAOYSA-N |
| Molecular Weight |
402.403 g/mol |
| SMILES |
N(C(C(NCC(C=1C=CC=CC1)O)=O)=O)C1=C(C=C(C(OC)=C1)OC)C(=O)OC |
![Benzoic acid, 2-[[2-[(2-hydroxy-2-phenylethyl)amino]-1,2-dioxoethyl]amino]-4,5-dimethoxy-, methyl ester](/api/spectrum/9DrF95QAKfo/structure.png?h=300&w=458 "Benzoic acid, 2-[[2-[(2-hydroxy-2-phenylethyl)amino]-1,2-dioxoethyl]amino]-4,5-dimethoxy-, methyl ester")
