CID 3078817

Benzamide, 4-amino-5-chloro-n-((4-(2-(dimethylamino)ethoxy)phenyl)methyl)-2-methoxy-

Structural Information

Molecular Formula
C19H24ClN3O3
SMILES
CN(C)CCOC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2OC)N)Cl
InChI
InChI=1S/C19H24ClN3O3/c1-23(2)8-9-26-14-6-4-13(5-7-14)12-22-19(24)15-10-16(20)17(21)11-18(15)25-3/h4-7,10-11H,8-9,12,21H2,1-3H3,(H,22,24)
InChIKey
BEAYKXCTVALCHX-UHFFFAOYSA-N
Compound name
4-amino-5-chloro-N-[[4-[2-(dimethylamino)ethoxy]phenyl]methyl]-2-methoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

377.1506 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.15788 191.2
[M+Na]+ 400.13982 197.3
[M-H]- 376.14332 198.7
[M+NH4]+ 395.18442 203.8
[M+K]+ 416.11376 193.6
[M+H-H2O]+ 360.14786 182.7
[M+HCOO]- 422.14880 212.0
[M+CH3COO]- 436.16445 228.8
[M+Na-2H]- 398.12527 191.3
[M]+ 377.15005 196.9
[M]- 377.15115 196.9
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