4-Methoxy-N-[(1R,9S)-11-(4-methoxybenzoyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]benzenesulfonamide

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Systematic / IUPAC Name: 4-Methoxy-N-[(1R,9S)-11-(4-methoxybenzoyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]benzenesulfonamide

ID: Reference13163

Other Names: NAT11-274706

Formula: C26H27N3O6S

Spectral Data

4-Methoxy-N-[(1R,9S)-11-(4-methoxybenzoyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]benzenesulfonamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 2
No. of Spectra 3310
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 5/31/2024 11:27:00 AM
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Identificators

InChI InChI=1S/C26H27N3O6S/c1-34-20-5-3-18(4-6-20)25(30)28-14-17-13-19(16-28)24-12-11-23(26(31)29(24)15-17)27-36(32,33)22-9-7-21(35-2)8-10-22/h3-12,17,19,27H,13-16H2,1-2H3/t17-,19+/m0/s1
InChI Key XXJNALKFPABMRN-PKOBYXMFSA-N
Canonical SMILES COC1=CC=C(C=C1)C(=O)N2CC3CC(C2)C4=CC=C(C(=O)N4C3)NS(=O)(=O)C5=CC=C(C=C5)OC
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Other Names NAT11-274706

In Other Databases

PubChem 7051260
ChemSpider 5409741