| SpectraBase Spectrum ID |
JIqrdCUaIKO |
| Name |
3-(4-Nitrophenyl)-5,7-diphenyl-1-tosyl-2,3-dihydro-1H-azepine |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H26N2O4S |
| InChI |
InChI=1S/C31H26N2O4S/c1-23-12-18-30(19-13-23)38(36,37)32-22-28(25-14-16-29(17-15-25)33(34)35)20-27(24-8-4-2-5-9-24)21-31(32)26-10-6-3-7-11-26/h2-21,28H,22H2,1H3 |
| InChIKey |
VVTMLSQBIHDIPK-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/anie.201304902 |
| Molecular Weight |
522.619 g/mol |
| SMILES |
C1N(C(c2ccccc2)=CC(c2ccccc2)=CC1c1ccc(cc1)[N+](=O)[O-])S(c1ccc(cc1)C)(=O)=O |
| SPLASH |
splash10-014i-4029020000-15a8d7cddda61a9d4b54 |
| Source of Spectrum |
ACI-52-SM-19 |
| Wiley ID |
1781798 |
