CID 135537764

Brn 6020762

Structural Information

Molecular Formula
C26H26N4O4
SMILES
CC1=CC2=C(C=C1)N(C(=C2N=NC(=O)COC3=CC4=CC=CC=C4C=C3)O)CN5CCOCC5
InChI
InChI=1S/C26H26N4O4/c1-18-6-9-23-22(14-18)25(26(32)30(23)17-29-10-12-33-13-11-29)28-27-24(31)16-34-21-8-7-19-4-2-3-5-20(19)15-21/h2-9,14-15,32H,10-13,16-17H2,1H3
InChIKey
XCLBGRMGKLQKRH-UHFFFAOYSA-N
Compound name
N-[2-hydroxy-5-methyl-1-(morpholin-4-ylmethyl)indol-3-yl]imino-2-naphthalen-2-yloxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

458.1954 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 459.20268 209.2
[M+Na]+ 481.18462 214.8
[M-H]- 457.18812 219.5
[M+NH4]+ 476.22922 216.6
[M+K]+ 497.15856 210.8
[M+H-H2O]+ 441.19266 196.9
[M+HCOO]- 503.19360 227.6
[M+CH3COO]- 517.20925 217.3
[M+Na-2H]- 479.17007 211.9
[M]+ 458.19485 212.2
[M]- 458.19595 212.2
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.