CID 135537734

Benzenesulfonic acid, (1-benzoyl-5-chloro-1,2-dihydro-2-oxo-3h-indol-3-ylidene)hydrazide

Structural Information

Molecular Formula
C21H14ClN3O4S
SMILES
C1=CC=C(C=C1)C(=O)N2C3=C(C=C(C=C3)Cl)C(=C2O)N=NS(=O)(=O)C4=CC=CC=C4
InChI
InChI=1S/C21H14ClN3O4S/c22-15-11-12-18-17(13-15)19(23-24-30(28,29)16-9-5-2-6-10-16)21(27)25(18)20(26)14-7-3-1-4-8-14/h1-13,27H
InChIKey
FJTYJBAQKPHADQ-UHFFFAOYSA-N
Compound name
N-(1-benzoyl-5-chloro-2-hydroxyindol-3-yl)iminobenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

439.03937 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 440.04665 202.2
[M+Na]+ 462.02859 212.9
[M-H]- 438.03209 214.3
[M+NH4]+ 457.07319 214.3
[M+K]+ 478.00253 206.6
[M+H-H2O]+ 422.03663 193.8
[M+HCOO]- 484.03757 218.9
[M+CH3COO]- 498.05322 213.1
[M+Na-2H]- 460.01404 206.7
[M]+ 439.03882 210.9
[M]- 439.03992 210.9
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.