Systematic / IUPAC Name: 2-Chloro-N-[[(2R,3R,4S,5S)-4-hydroxy-5-(hydroxymethyl)-3-(4-phenylpiperazin-1-yl)oxolan-2-yl]methyl]-5-methoxybenzamide
ID: Reference10150
Other Names:
D-Galactitol, 2,5-anhydro-6-[(2-chloro-5-methoxybenzoyl)amino]-4,6-dideoxy-4-(4-phenyl-1-piperazinyl)-;
NAT27-501581
Formula: C24H30ClN3O5
2,5-Anhydro-6-[(2-chloro-5-methoxybenzoyl)amino]-4,6-dideoxy-4-(4-phenyl-1-piperazinyl)-D-galactitol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 1 |
No. of Spectra | 1808 |
Tandem Spectra | MS1, MS2, MS3, MS4, MS5 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 12/18/2020 11:10:07 AM |
InChI | InChI=1S/C24H30ClN3O5/c1-32-17-7-8-19(25)18(13-17)24(31)26-14-20-22(23(30)21(15-29)33-20)28-11-9-27(10-12-28)16-5-3-2-4-6-16/h2-8,13,20-23,29-30H,9-12,14-15H2,1H3,(H,26,31)/t20-,21+,22+,23-/m1/s1 |
InChI Key | YSOYHGVIOWUBMQ-WZYRSQIMSA-N |
Canonical SMILES | COC1=CC(=C(C=C1)Cl)C(=O)NCC2C(C(C(O2)CO)O)N3CCN(CC3)C4=CC=CC=C4 |
CAS | |
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Other Names |
D-Galactitol, 2,5-anhydro-6-[(2-chloro-5-methoxybenzoyl)amino]-4,6-dideoxy-4-(4-phenyl-1-piperazinyl)-; NAT27-501581 |