CID 3047040

Benzenesulfonamide, 4-amino-5-chloro-2-methoxy-n-(3-(4-morpholinyl)propyl)-, monohydrochloride

Structural Information

Molecular Formula
C14H22ClN3O4S
SMILES
COC1=C(C=C(C(=C1)N)Cl)S(=O)(=O)NCCCN2CCOCC2
InChI
InChI=1S/C14H22ClN3O4S/c1-21-13-10-12(16)11(15)9-14(13)23(19,20)17-3-2-4-18-5-7-22-8-6-18/h9-10,17H,2-8,16H2,1H3
InChIKey
ZLWRWKZEDDUCCE-UHFFFAOYSA-N
Compound name
4-amino-5-chloro-2-methoxy-N-(3-morpholin-4-ylpropyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

363.10196 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.10924 181.5
[M+Na]+ 386.09118 190.9
[M+NH4]+ 381.13578 187.2
[M+K]+ 402.06512 184.3
[M-H]- 362.09468 184.8
[M+Na-2H]- 384.07663 185.2
[M]+ 363.10141 184.2
[M]- 363.10251 184.2
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

No patent data available for this compound.