CID 3062052

Acetamide, n-(2-benzoyl-4-nitrophenyl)-2-(cyclopropylamino)-n-methyl-

Structural Information

Molecular Formula
C19H19N3O4
SMILES
CN(C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)C2=CC=CC=C2)C(=O)CNC3CC3
InChI
InChI=1S/C19H19N3O4/c1-21(18(23)12-20-14-7-8-14)17-10-9-15(22(25)26)11-16(17)19(24)13-5-3-2-4-6-13/h2-6,9-11,14,20H,7-8,12H2,1H3
InChIKey
FFTGLNRRSPNPEV-UHFFFAOYSA-N
Compound name
N-(2-benzoyl-4-nitrophenyl)-2-(cyclopropylamino)-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

353.13754 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.14482 182.6
[M+Na]+ 376.12676 195.4
[M+NH4]+ 371.17136 189.5
[M+K]+ 392.10070 193.3
[M-H]- 352.13026 195.9
[M+Na-2H]- 374.11221 192.4
[M]+ 353.13699 189.0
[M]- 353.13809 189.0
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