CID 135684852

4-cl-n-(2-((2-(2,4-dihydroxybenzylidene)hydrazino)carbonyl)ph)benzenesulfonamide

Structural Information

Molecular Formula
C20H16ClN3O5S
SMILES
C1=CC=C(C(=C1)C(=O)N/N=C/C2=C(C=C(C=C2)O)O)NS(=O)(=O)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C20H16ClN3O5S/c21-14-6-9-16(10-7-14)30(28,29)24-18-4-2-1-3-17(18)20(27)23-22-12-13-5-8-15(25)11-19(13)26/h1-12,24-26H,(H,23,27)/b22-12+
InChIKey
IIMLEFASKLWZNO-WSDLNYQXSA-N
Compound name
2-[(4-chlorophenyl)sulfonylamino]-N-[(E)-(2,4-dihydroxyphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

445.04993 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 446.05721 199.0
[M+Na]+ 468.03915 205.6
[M-H]- 444.04265 207.7
[M+NH4]+ 463.08375 207.3
[M+K]+ 484.01309 199.0
[M+H-H2O]+ 428.04719 190.6
[M+HCOO]- 490.04813 213.6
[M+CH3COO]- 504.06378 229.0
[M+Na-2H]- 466.02460 202.9
[M]+ 445.04938 202.8
[M]- 445.05048 202.8
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