| SpectraBase Spectrum ID |
3mmV7IBLhQS |
| Name |
1-Benzothiepin-3-ol, 5-methoxy-4-phenyl-, acetate, 1,1-dioxide |
| Alternate Name(s) |
3-Acetoxy-5-methoxy-4-phenyl-1-benzothiepin-1,1-dioxide
5-Methoxy-1,1-dioxido-4-phenyl-1-benzothiepin-3-yl acetate |
| CAS Registry Number |
57458-91-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H16O5S |
| InChI |
InChI=1S/C19H16O5S/c1-13(20)24-16-12-25(21,22)17-11-7-6-10-15(17)19(23-2)18(16)14-8-4-3-5-9-14/h3-12H,1-2H3 |
| InChIKey |
FBFOMFTUBJEWFT-UHFFFAOYSA-N |
| Molecular Weight |
356.392 g/mol |
| SMILES |
C=1S(c2c(C(=C(C1OC(=O)C)c1ccccc1)OC)cccc2)(=O)=O |
| SPLASH |
splash10-0zfr-0089000000-0e480c0d974cec4dd85f |
| Source of Spectrum |
K-112-789-0 |
| Wiley ID |
1345709 |
