CID 507214

4-[[2-(4-chlorophenoxy)acetyl]amino]-n-(5-methylisoxazol-3-yl)benzamide

Structural Information

Molecular Formula
C19H16ClN3O4
SMILES
CC1=CC(=NO1)NC(=O)C2=CC=C(C=C2)NC(=O)COC3=CC=C(C=C3)Cl
InChI
InChI=1S/C19H16ClN3O4/c1-12-10-17(23-27-12)22-19(25)13-2-6-15(7-3-13)21-18(24)11-26-16-8-4-14(20)5-9-16/h2-10H,11H2,1H3,(H,21,24)(H,22,23,25)
InChIKey
WKUNLPDJDLFXFT-UHFFFAOYSA-N
Compound name
4-[[2-(4-chlorophenoxy)acetyl]amino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

385.08295 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 386.09023 189.8
[M+Na]+ 408.07217 196.7
[M-H]- 384.07567 199.4
[M+NH4]+ 403.11677 200.2
[M+K]+ 424.04611 192.8
[M+H-H2O]+ 368.08021 180.5
[M+HCOO]- 430.08115 208.9
[M+CH3COO]- 444.09680 220.0
[M+Na-2H]- 406.05762 191.7
[M]+ 385.08240 194.9
[M]- 385.08350 194.9
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

No patent data available for this compound.