CID 3704448

3-amino-n-(4-ethoxyphenyl)-4-methoxybenzene-1-sulfonamide

Structural Information

Molecular Formula
C15H18N2O4S
SMILES
CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)OC)N
InChI
InChI=1S/C15H18N2O4S/c1-3-21-12-6-4-11(5-7-12)17-22(18,19)13-8-9-15(20-2)14(16)10-13/h4-10,17H,3,16H2,1-2H3
InChIKey
HPLLPTUQWXUKNF-UHFFFAOYSA-N
Compound name
3-amino-N-(4-ethoxyphenyl)-4-methoxybenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

322.09872 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.105996 171.7
[M+Na]+ 345.087938 179.2
[M-H]- 321.091444 178.3
[M+NH4]+ 340.132543 185.6
[M+K]+ 361.061878 175.1
[M+H-H2O]+ 305.095980 163.6
[M+HCOO]- 367.096921 191.4
[M+CH3COO]- 381.112571 209.0
[M+Na-2H]- 343.073386 175.5
[M]+ 322.09817142 175.7
[M]- 322.09926858 175.7
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