1-(4-Benzyl-1-piperazinyl)-2-[(3R,4S)-3-{[5-(cyclohexylmethyl)-1,2-oxazol-3-yl]methyl}-4-piperidinyl]ethanone

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Systematic / IUPAC Name: 1-(4-Benzylpiperazin-1-yl)-2-[(3R,4S)-3-[[5-(cyclohexylmethyl)-1,2-oxazol-3-yl]methyl]piperidin-4-yl]ethanone

ID: Reference9552

Other Names: Ethanone, 2-[(3R,4S)-3-[[5-(cyclohexylmethyl)-3-isoxazolyl]methyl]-4-piperidinyl]-1-[4-(phenylmethyl)-1-piperazinyl]-;
NAT14-350357

Formula: C29H42N4O2

Spectral Data

1-(4-Benzyl-1-piperazinyl)-2-[(3R,4S)-3-{[5-(cyclohexylmethyl)-1,2-oxazol-3-yl]methyl}-4-piperidinyl]ethanone 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 1
No. of Spectra 1486
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 4/1/2020 8:54:23 AM
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Identificators

InChI InChI=1S/C29H42N4O2/c34-29(33-15-13-32(14-16-33)22-24-9-5-2-6-10-24)19-25-11-12-30-21-26(25)18-27-20-28(35-31-27)17-23-7-3-1-4-8-23/h2,5-6,9-10,20,23,25-26,30H,1,3-4,7-8,11-19,21-22H2/t25-,26-/m0/s1
InChI Key WVATWFNFEUOMKG-UIOOFZCWSA-N
Canonical SMILES C1CCC(CC1)CC2=CC(=NO2)CC3CNCCC3CC(=O)N4CCN(CC4)CC5=CC=CC=C5
CAS
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Other Names Ethanone, 2-[(3R,4S)-3-[[5-(cyclohexylmethyl)-3-isoxazolyl]methyl]-4-piperidinyl]-1-[4-(phenylmethyl)-1-piperazinyl]-;
NAT14-350357

In Other Databases

PubChem 26743244
ChemSpider 21385009