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]+ 438.14821 203.0
[M+Na]+ 460.13015 207.1
[M-H]- 436.13365 213.0
[M+NH4]+ 455.17475 211.5
[M+K]+ 476.10409 201.7
[M+H-H2O]+ 420.13819 192.1
[M+HCOO]- 482.13913 223.7
[M+CH3COO]- 496.15478 233.6
[M+Na-2H]- 458.11560 207.5
[M]+ 437.14038 206.4
[M]- 437.14148 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.