(1R,9R)-5-{[(4-Acetylphenyl)carbamoyl]amino}-N-cyclohexyl-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
11973
Reference
(1R,9R)-5-{[(4-Acetylphenyl)carbamoyl]amino}-N-cyclohexyl-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide Structure
Systematic / IUPAC Name: (1R,9R)-5-[(4-Acetylphenyl)carbamoylamino]-N-cyclohexyl-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
ID: Reference11973
Other Names: NAT11-275227
Formula: C27H33N5O4
Spectral Data
(1R,9R)-5-{[(4-Acetylphenyl)carbamoyl]amino}-N-cyclohexyl-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide 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 | 2285 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 11/21/2022 2:50:01 PM |
Identificators
| InChI | InChI=1S/C27H33N5O4/c1-17(33)19-7-9-22(10-8-19)28-26(35)30-23-11-12-24-20-13-18(15-32(24)25(23)34)14-31(16-20)27(36)29-21-5-3-2-4-6-21/h7-12,18,20-21H,2-6,13-16H2,1H3,(H,29,36)(H2,28,30,35)/t18-,20+/m0/s1 |
| InChI Key | KMZORYWEFWZNHX-AZUAARDMSA-N |
| Canonical SMILES | CC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC=C3C4CC(CN(C4)C(=O)NC5CCCCC5)CN3C2=O |
| CAS | |
| Splash | |
| Other Names | NAT11-275227 |