Systematic / IUPAC Name: (1R,9R)-N-(4-Fluorophenyl)-5-[(2-methoxyphenyl)carbamoylamino]-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
ID: Reference12656
Other Names: NAT11-292390
Formula: C26H26FN5O4
(1R,9R)-N-(4-Fluorophenyl)-5-{[(2-methoxyphenyl)carbamoyl]amino}-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.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 2302 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 7/17/2023 8:54:44 AM |
InChI | InChI=1S/C26H26FN5O4/c1-36-23-5-3-2-4-20(23)29-25(34)30-21-10-11-22-17-12-16(14-32(22)24(21)33)13-31(15-17)26(35)28-19-8-6-18(27)7-9-19/h2-11,16-17H,12-15H2,1H3,(H,28,35)(H2,29,30,34)/t16-,17+/m0/s1 |
InChI Key | QJYAYCROVFKQJS-DLBZAZTESA-N |
Canonical SMILES | COC1=CC=CC=C1NC(=O)NC2=CC=C3C4CC(CN(C4)C(=O)NC5=CC=C(C=C5)F)CN3C2=O |
CAS | |
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Other Names | NAT11-292390 |