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

ID: Reference10129

Other Names: Benzenesulfonamide, 4-chloro-N-[(1R,5S)-1,3,4,5,6,8-hexahydro-8-oxo-3-(2-phenoxyacetyl)-1,5-methano-2H-pyrido[1,2-a][1,5]diazocin-9-yl]-;
NAT11-274921

Formula: C25H24ClN3O5S

Spectral Data

4-Chloro-N-[(1R,9S)-6-oxo-11-(phenoxyacetyl)-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 2849
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 12/4/2020 11:00:17 AM
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Identificators

InChI InChI=1S/C25H24ClN3O5S/c26-19-6-8-21(9-7-19)35(32,33)27-22-10-11-23-18-12-17(14-29(23)25(22)31)13-28(15-18)24(30)16-34-20-4-2-1-3-5-20/h1-11,17-18,27H,12-16H2/t17-,18+/m0/s1
InChI Key XZVOBVDDMDLKDA-ZWKOTPCHSA-N
Canonical SMILES C1C2CN(CC1C3=CC=C(C(=O)N3C2)NS(=O)(=O)C4=CC=C(C=C4)Cl)C(=O)COC5=CC=CC=C5
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Other Names Benzenesulfonamide, 4-chloro-N-[(1R,5S)-1,3,4,5,6,8-hexahydro-8-oxo-3-(2-phenoxyacetyl)-1,5-methano-2H-pyrido[1,2-a][1,5]diazocin-9-yl]-;
NAT11-274921

In Other Databases

PubChem 7051280
ChemSpider 5409746