CID 135537765

Brn 6018972

Structural Information

Molecular Formula
C27H28N4O3
SMILES
CC1=CC2=C(C=C1)N(C(=C2N=NC(=O)COC3=CC4=CC=CC=C4C=C3)O)CN5CCCCC5
InChI
InChI=1S/C27H28N4O3/c1-19-9-12-24-23(15-19)26(27(33)31(24)18-30-13-5-2-6-14-30)29-28-25(32)17-34-22-11-10-20-7-3-4-8-21(20)16-22/h3-4,7-12,15-16,33H,2,5-6,13-14,17-18H2,1H3
InChIKey
QBOJWZURRXTSOY-UHFFFAOYSA-N
Compound name
N-[2-hydroxy-5-methyl-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

456.21616 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 457.22344 212.3
[M+Na]+ 479.20538 226.1
[M+NH4]+ 474.24998 219.2
[M+K]+ 495.17932 218.8
[M-H]- 455.20888 219.3
[M+Na-2H]- 477.19083 219.7
[M]+ 456.21561 216.1
[M]- 456.21671 216.1
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.