CID 11258736

Tamsulosin ether

Structural Information

Molecular Formula
C20H26N2O6S
SMILES
CCOC1=CC=CC=C1OCC(=O)N[C@H](C)CC2=CC(=C(C=C2)OC)S(=O)(=O)N
InChI
InChI=1S/C20H26N2O6S/c1-4-27-16-7-5-6-8-17(16)28-13-20(23)22-14(2)11-15-9-10-18(26-3)19(12-15)29(21,24)25/h5-10,12,14H,4,11,13H2,1-3H3,(H,22,23)(H2,21,24,25)/t14-/m1/s1
InChIKey
IPHNYXYPQJHUIV-CQSZACIVSA-N
Compound name
2-(2-ethoxyphenoxy)-N-[(2R)-1-(4-methoxy-3-sulfamoylphenyl)propan-2-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

422.15115 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 423.15843 197.9
[M+Na]+ 445.14037 206.1
[M+NH4]+ 440.18497 201.6
[M+K]+ 461.11431 200.6
[M-H]- 421.14387 199.4
[M+Na-2H]- 443.12582 202.2
[M]+ 422.15060 199.5
[M]- 422.15170 199.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe