SpectraBase Spectrum ID |
3FWCQosho0i |
Name |
Benzenesulfonamide, N-[4-[[4-(hexyloxy)phenyl]amino]-2-methyl-6-(phenylsulfonyl)phenyl]-2,4,6-tris(1-methylethyl)- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
704.331765125 u |
Formula |
C40H52N2O5S2 |
InChI |
InChI=1S/C40H52N2O5S2/c1-9-10-11-15-22-47-34-20-18-32(19-21-34)41-33-23-30(8)39(38(26-33)48(43,44)35-16-13-12-14-17-35)42-49(45,46)40-36(28(4)5)24-31(27(2)3)25-37(40)29(6)7/h12-14,16-21,23-29,41-42H,9-11,15,22H2,1-8H3 |
InChIKey |
WPDIJTOEYWOPCP-UHFFFAOYSA-N |
SMILES |
C1(=CC=CC=C1)S(C1=CC(NC2=CC=C(OCCCCCC)C=C2)=CC(C)=C1NS(=O)(=O)C1=C(C=C(C=C1C(C)C)C(C)C)C(C)C)(=O)=O |