CID 135599727

Brn 6018828

Structural Information

Molecular Formula
C25H24N4O3
SMILES
C1CCN(C1)CN2C3=CC=CC=C3C(=C2O)N=NC(=O)COC4=CC5=CC=CC=C5C=C4
InChI
InChI=1S/C25H24N4O3/c30-23(16-32-20-12-11-18-7-1-2-8-19(18)15-20)26-27-24-21-9-3-4-10-22(21)29(25(24)31)17-28-13-5-6-14-28/h1-4,7-12,15,31H,5-6,13-14,16-17H2
InChIKey
NYQKBDFMQKLXJI-UHFFFAOYSA-N
Compound name
N-[2-hydroxy-1-(pyrrolidin-1-ylmethyl)indol-3-yl]imino-2-naphthalen-2-yloxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

428.18484 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 429.19212 202.9
[M+Na]+ 451.17406 215.7
[M+NH4]+ 446.21866 210.0
[M+K]+ 467.14800 211.1
[M-H]- 427.17756 209.3
[M+Na-2H]- 449.15951 210.2
[M]+ 428.18429 206.4
[M]- 428.18539 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.