CID 135537726

Benzenesulfonic acid, (1-benzoyl-1,2-dihydro-2-oxo-3h-indol-3-ylidene)hydrazide

Structural Information

Molecular Formula
C21H15N3O4S
SMILES
C1=CC=C(C=C1)C(=O)N2C3=CC=CC=C3C(=C2O)N=NS(=O)(=O)C4=CC=CC=C4
InChI
InChI=1S/C21H15N3O4S/c25-20(15-9-3-1-4-10-15)24-18-14-8-7-13-17(18)19(21(24)26)22-23-29(27,28)16-11-5-2-6-12-16/h1-14,26H
InChIKey
CVGNOBBNMGFCHU-UHFFFAOYSA-N
Compound name
N-(1-benzoyl-2-hydroxyindol-3-yl)iminobenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

405.07834 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 406.08562 194.3
[M+Na]+ 428.06756 203.6
[M-H]- 404.07106 206.1
[M+NH4]+ 423.11216 206.6
[M+K]+ 444.04150 198.3
[M+H-H2O]+ 388.07560 185.1
[M+HCOO]- 450.07654 215.6
[M+CH3COO]- 464.09219 223.8
[M+Na-2H]- 426.05301 200.0
[M]+ 405.07779 200.1
[M]- 405.07889 200.1
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.