| SpectraBase Spectrum ID |
KsRQwrJW2jh |
| Name |
3-Benzoyl-2-methyl-1,1-dioxido-2H-1,2-benzothiazin-4-yl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
502.083472095 u |
| Formula |
C26H18N2O7S |
| InChI |
InChI=1S/C26H18N2O7S/c1-27-22(23(30)16-9-3-2-4-10-16)24(19-13-7-8-14-20(19)36(27,33)34)35-21(29)15-28-25(31)17-11-5-6-12-18(17)26(28)32/h2-14H,15H2,1H3 |
| InChIKey |
CSJPZYQPQALSSV-UHFFFAOYSA-N |
| Molecular Weight |
502.497 g/mol |
| SMILES |
C=1C=CC(C(C=2N(S(C=3C(C2OC(CN2C(C4=CC=CC=C4C2=O)=O)=O)=CC=CC3)(=O)=O)C)=O)=CC1 |
