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]+ 378.111826 184.5
[M+Na]+ 400.093768 189.2
[M-H]- 376.097274 190.6
[M+NH4]+ 395.138373 195.2
[M+K]+ 416.067708 185.1
[M+H-H2O]+ 360.101810 175.3
[M+HCOO]- 422.102751 204.6
[M+CH3COO]- 436.118401 219.8
[M+Na-2H]- 398.079216 188.9
[M]+ 377.10400142 188.0
[M]- 377.10509858 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.