SpectraBase Spectrum ID |
1O5qk7TL0MB |
Name |
Propanamide, 3-[(4-bromophenyl)sulfonyl]-N-(2-chloro-4-methylphenyl)- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
414.964455218 u |
Formula |
C16H15BrClNO3S |
InChI |
InChI=1S/C16H15BrClNO3S/c1-11-2-7-15(14(18)10-11)19-16(20)8-9-23(21,22)13-5-3-12(17)4-6-13/h2-7,10H,8-9H2,1H3,(H,19,20) |
InChIKey |
KJTOKJJFCKSXEF-UHFFFAOYSA-N |
Molecular Weight |
416.717 g/mol |
SMILES |
N(C(CCS(C=1C=CC(=CC1)Br)(=O)=O)=O)C1=C(C=C(C=C1)C)Cl |