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

ID: Reference10119

Other Names: Benzenesulfonamide, 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]-;
NAT11-274924

Formula: C25H25N3O5S

Spectral Data

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 3079
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 12/4/2020 10:52:42 AM
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Identificators

InChI InChI=1S/C25H25N3O5S/c29-24(17-33-20-7-3-1-4-8-20)27-14-18-13-19(16-27)23-12-11-22(25(30)28(23)15-18)26-34(31,32)21-9-5-2-6-10-21/h1-12,18-19,26H,13-17H2/t18-,19+/m0/s1
InChI Key UVMFBADHZIUQHW-RBUKOAKNSA-N
Canonical SMILES C1C2CN(CC1C3=CC=C(C(=O)N3C2)NS(=O)(=O)C4=CC=CC=C4)C(=O)COC5=CC=CC=C5
CAS
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Other Names Benzenesulfonamide, 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]-;
NAT11-274924

In Other Databases

ChemSpider 5409747
PubChem 7051282