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

ID: Reference13198

Other Names: NAT11-274699

Formula: C25H24ClN3O5S

Spectral Data

4-Chloro-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 3230
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 6/21/2024 1:42:28 PM
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Identificators

InChI InChI=1S/C25H24ClN3O5S/c1-34-20-6-2-17(3-7-20)24(30)28-13-16-12-18(15-28)23-11-10-22(25(31)29(23)14-16)27-35(32,33)21-8-4-19(26)5-9-21/h2-11,16,18,27H,12-15H2,1H3/t16-,18+/m0/s1
InChI Key DTZAHEGOJJKCBE-FUHWJXTLSA-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)Cl
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Other Names NAT11-274699

In Other Databases

ChemSpider 5409738
PubChem 7051255