4-Fluoro-N-{[(1S,4S,6S)-6-isopropyl-3-methyl-4-(2-{[2-(4-morpholinyl)ethyl]amino}-2-oxoethyl)-2-cyclohexen-1-yl]methyl}benzamide

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Systematic / IUPAC Name: 4-Fluoro-N-[[(1S,4S,6S)-3-methyl-4-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-6-propan-2-ylcyclohex-2-en-1-yl]methyl]benzamide

ID: Reference10431

Other Names: Benzamide, 4-fluoro-N-[[(1S,4S,6S)-3-methyl-6-(1-methylethyl)-4-[2-[[2-(4-morpholinyl)ethyl]amino]-2-oxoethyl]-2-cyclohexen-1-yl]methyl]-;
NAT28-402258

Formula: C26H38FN3O3

Spectral Data

4-Fluoro-N-{[(1S,4S,6S)-6-isopropyl-3-methyl-4-(2-{[2-(4-morpholinyl)ethyl]amino}-2-oxoethyl)-2-cyclohexen-1-yl]methyl}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 2973
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 5/6/2021 2:19:20 PM
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Identificators

InChI InChI=1S/C26H38FN3O3/c1-18(2)24-15-21(16-25(31)28-8-9-30-10-12-33-13-11-30)19(3)14-22(24)17-29-26(32)20-4-6-23(27)7-5-20/h4-7,14,18,21-22,24H,8-13,15-17H2,1-3H3,(H,28,31)(H,29,32)/t21-,22-,24-/m0/s1
InChI Key VFOJTRKXCVUSLX-FIXSFTCYSA-N
Canonical SMILES CC1=CC(C(CC1CC(=O)NCCN2CCOCC2)C(C)C)CNC(=O)C3=CC=C(C=C3)F
CAS
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Other Names Benzamide, 4-fluoro-N-[[(1S,4S,6S)-3-methyl-6-(1-methylethyl)-4-[2-[[2-(4-morpholinyl)ethyl]amino]-2-oxoethyl]-2-cyclohexen-1-yl]methyl]-;
NAT28-402258

In Other Databases

PubChem 38027112
ChemSpider 22936981