SpectraBase Spectrum ID |
Itfa5NRbGUj |
Name |
1-(1-adamantyl)-4-(4-chloranyl-3-methoxy-phenyl)sulfonyl-piperazine |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H29ClN2O3S |
InChI |
InChI=1S/C21H29ClN2O3S/c1-27-20-11-18(2-3-19(20)22)28(25,26)24-6-4-23(5-7-24)21-12-15-8-16(13-21)10-17(9-15)14-21/h2-3,11,15-17H,4-10,12-14H2,1H3 |
InChIKey |
QNNSJDHXSIXDTL-UHFFFAOYSA-N |
Molecular Weight |
424.987 g/mol |
SMILES |
COc1cc(S(N2CCN(C34CC5CC(C4)CC(C3)C5)CC2)(=O)=O)ccc1Cl |
SPLASH |
splash10-00kr-3930000000-85822d5cb9fd55a1be3d |
Synonyms |
1-(1-adamantyl)-4-(4-chloro-3-methoxyphenyl)sulfonylpiperazine |
Wiley ID |
1465124 |