CID 135822348

N-(2-(2-(3-ethoxy-4-hydroxybenzylidene)hydrazino)-2-oxoethyl)benzenesulfonamide

Structural Information

Molecular Formula
C17H19N3O5S
SMILES
CCOC1=C(C=CC(=C1)/C=N/NC(=O)CNS(=O)(=O)C2=CC=CC=C2)O
InChI
InChI=1S/C17H19N3O5S/c1-2-25-16-10-13(8-9-15(16)21)11-18-20-17(22)12-19-26(23,24)14-6-4-3-5-7-14/h3-11,19,21H,2,12H2,1H3,(H,20,22)/b18-11+
InChIKey
AOYAKAZMXTXZIB-WOJGMQOQSA-N
Compound name
2-(benzenesulfonamido)-N-[(E)-(3-ethoxy-4-hydroxyphenyl)methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

377.10455 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.11183 184.5
[M+Na]+ 400.09377 189.2
[M-H]- 376.09727 190.6
[M+NH4]+ 395.13837 195.2
[M+K]+ 416.06771 185.1
[M+H-H2O]+ 360.10181 175.3
[M+HCOO]- 422.10275 204.6
[M+CH3COO]- 436.11840 219.8
[M+Na-2H]- 398.07922 188.9
[M]+ 377.10400 188.0
[M]- 377.10510 188.0
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.