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

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Systematic / IUPAC Name: N-[(1R,9S)-6-Oxo-11-(4-phenylbenzoyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]benzamide

ID: Reference9993

Other Names: Benzamide, N-[(1R,5S)-3-([1,1'-biphenyl]-4-ylcarbonyl)-1,3,4,5,6,8-hexahydro-8-oxo-1,5-methano-2H-pyrido[1,2-a][1,5]diazocin-9-yl]-;
NAT11-291842

Formula: C31H27N3O3

Spectral Data

N-[(1R,9S)-11-(4-Biphenylylcarbonyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]benzamide 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 2505
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 10/21/2020 12:12:33 PM
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Identificators

InChI InChI=1S/C31H27N3O3/c35-29(24-9-5-2-6-10-24)32-27-15-16-28-26-17-21(19-34(28)31(27)37)18-33(20-26)30(36)25-13-11-23(12-14-25)22-7-3-1-4-8-22/h1-16,21,26H,17-20H2,(H,32,35)/t21-,26+/m0/s1
InChI Key WLEQAXPBNZYLGI-HFZDXXHNSA-N
Canonical SMILES C1C2CN(CC1C3=CC=C(C(=O)N3C2)NC(=O)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)C6=CC=CC=C6
CAS
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Other Names Benzamide, N-[(1R,5S)-3-([1,1'-biphenyl]-4-ylcarbonyl)-1,3,4,5,6,8-hexahydro-8-oxo-1,5-methano-2H-pyrido[1,2-a][1,5]diazocin-9-yl]-;
NAT11-291842

In Other Databases

PubChem 7155494
ChemSpider 5495653