CID 11739408

745047-53-4

Structural Information

Molecular Formula
C18H21N3O4
SMILES
COC1=CC(=C(C=C1)CNC(=O)C(=O)NCCC2=CC=CC=N2)OC
InChI
InChI=1S/C18H21N3O4/c1-24-15-7-6-13(16(11-15)25-2)12-21-18(23)17(22)20-10-8-14-5-3-4-9-19-14/h3-7,9,11H,8,10,12H2,1-2H3,(H,20,22)(H,21,23)
InChIKey
HETCYFFYGYGQSP-UHFFFAOYSA-N
Compound name
N'-[(2,4-dimethoxyphenyl)methyl]-N-(2-pyridin-2-ylethyl)oxamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

269
Patents

343.1532 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.16048 181.8
[M+Na]+ 366.14242 192.3
[M+NH4]+ 361.18702 186.7
[M+K]+ 382.11636 186.7
[M-H]- 342.14592 184.5
[M+Na-2H]- 364.12787 188.1
[M]+ 343.15265 183.7
[M]- 343.15375 183.7
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

patents stripe