N-{(1R,9R)-11-[(4-Chlorophenyl)sulfonyl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl}-4-methoxybenzamide
12033
Reference
N-{(1R,9R)-11-[(4-Chlorophenyl)sulfonyl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl}-4-methoxybenzamide Structure
Systematic / IUPAC Name: N-[(1R,9R)-11-(4-Chlorophenyl)sulfonyl-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]-4-methoxybenzamide
ID: Reference12033
Other Names: NAT11-276174
Formula: C25H24ClN3O5S
Spectral Data
N-{(1R,9R)-11-[(4-Chlorophenyl)sulfonyl]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl}-4-methoxybenzamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 1 |
| No. of Spectra | 978 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 12/6/2022 8:27:31 AM |
Identificators
| InChI | InChI=1S/C25H24ClN3O5S/c1-34-20-6-2-17(3-7-20)24(30)27-22-10-11-23-18-12-16(14-29(23)25(22)31)13-28(15-18)35(32,33)21-8-4-19(26)5-9-21/h2-11,16,18H,12-15H2,1H3,(H,27,30)/t16-,18+/m0/s1 |
| InChI Key | FGKCUXNGIVUCLQ-FUHWJXTLSA-N |
| Canonical SMILES | COC1=CC=C(C=C1)C(=O)NC2=CC=C3C4CC(CN(C4)S(=O)(=O)C5=CC=C(C=C5)Cl)CN3C2=O |
| CAS | |
| Splash | |
| Other Names | NAT11-276174 |