CID 135599732

Brn 6020785

Structural Information

Molecular Formula
C26H26N4O3
SMILES
C1CCN(CC1)CN2C3=CC=CC=C3C(=C2O)N=NC(=O)COC4=CC5=CC=CC=C5C=C4
InChI
InChI=1S/C26H26N4O3/c31-24(17-33-21-13-12-19-8-2-3-9-20(19)16-21)27-28-25-22-10-4-5-11-23(22)30(26(25)32)18-29-14-6-1-7-15-29/h2-5,8-13,16,32H,1,6-7,14-15,17-18H2
InChIKey
HVTKMLGQMNLVIN-UHFFFAOYSA-N
Compound name
N-[2-hydroxy-1-(piperidin-1-ylmethyl)indol-3-yl]imino-2-naphthalen-2-yloxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

442.2005 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 443.20778 203.7
[M+Na]+ 465.18972 208.4
[M-H]- 441.19322 212.9
[M+NH4]+ 460.23432 212.8
[M+K]+ 481.16366 202.5
[M+H-H2O]+ 425.19776 191.1
[M+HCOO]- 487.19870 222.9
[M+CH3COO]- 501.21435 211.6
[M+Na-2H]- 463.17517 206.8
[M]+ 442.19995 204.3
[M]- 442.20105 204.3
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.