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

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

ID: Reference10100

Other Names: Benzenesulfonamide, N-[(1R,5S)-3-(1-acetyl-4-piperidinyl)-1,3,4,5,6,8-hexahydro-8-oxo-1,5-methano-2H-pyrido[1,2-a][1,5]diazocin-9-yl]-4-chloro-;
NAT11-295169

Formula: C24H29ClN4O4S

Spectral Data

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

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 755
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 11/27/2020 11:02:47 AM
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Identificators

InChI InChI=1S/C24H29ClN4O4S/c1-16(30)27-10-8-20(9-11-27)28-13-17-12-18(15-28)23-7-6-22(24(31)29(23)14-17)26-34(32,33)21-4-2-19(25)3-5-21/h2-7,17-18,20,26H,8-15H2,1H3/t17-,18+/m0/s1
InChI Key AAENKYMTBPMFLZ-ZWKOTPCHSA-N
Canonical SMILES CC(=O)N1CCC(CC1)N2CC3CC(C2)C4=CC=C(C(=O)N4C3)NS(=O)(=O)C5=CC=C(C=C5)Cl
CAS
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Other Names Benzenesulfonamide, N-[(1R,5S)-3-(1-acetyl-4-piperidinyl)-1,3,4,5,6,8-hexahydro-8-oxo-1,5-methano-2H-pyrido[1,2-a][1,5]diazocin-9-yl]-4-chloro-;
NAT11-295169

In Other Databases

PubChem 7051417
ChemSpider 5409785