CID 9631087

N-(2-(2-(4-((4-me-benzyl)oxy)benzylidene)hydrazino)2-oxoethyl)benzenesulfonamide

Structural Information

Molecular Formula
C23H23N3O4S
SMILES
CC1=CC=C(C=C1)COC2=CC=C(C=C2)/C=N/NC(=O)CNS(=O)(=O)C3=CC=CC=C3
InChI
InChI=1S/C23H23N3O4S/c1-18-7-9-20(10-8-18)17-30-21-13-11-19(12-14-21)15-24-26-23(27)16-25-31(28,29)22-5-3-2-4-6-22/h2-15,25H,16-17H2,1H3,(H,26,27)/b24-15+
InChIKey
PHIVKUZQJRHWMR-BUVRLJJBSA-N
Compound name
2-(benzenesulfonamido)-N-[(E)-[4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

437.14093 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 438.148206 203.0
[M+Na]+ 460.130148 207.1
[M-H]- 436.133654 213.0
[M+NH4]+ 455.174753 211.5
[M+K]+ 476.104088 201.7
[M+H-H2O]+ 420.138190 192.1
[M+HCOO]- 482.139131 223.7
[M+CH3COO]- 496.154781 233.6
[M+Na-2H]- 458.115596 207.5
[M]+ 437.14038142 206.4
[M]- 437.14147858 206.4
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.