CID 3067711

81870-66-8

Structural Information

Molecular Formula
C16H17N3O5S
SMILES
COC1=CC=CC=C1C(=O)NCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N
InChI
InChI=1S/C16H17N3O5S/c1-24-14-5-3-2-4-13(14)16(21)18-10-15(20)19-11-6-8-12(9-7-11)25(17,22)23/h2-9H,10H2,1H3,(H,18,21)(H,19,20)(H2,17,22,23)
InChIKey
MZADKGZRSLWDTP-UHFFFAOYSA-N
Compound name
2-methoxy-N-[2-oxo-2-(4-sulfamoylanilino)ethyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

363.0889 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.096176 180.8
[M+Na]+ 386.078118 185.6
[M-H]- 362.081624 186.7
[M+NH4]+ 381.122723 191.8
[M+K]+ 402.052058 182.1
[M+H-H2O]+ 346.086160 172.0
[M+HCOO]- 408.087101 199.5
[M+CH3COO]- 422.102751 217.3
[M+Na-2H]- 384.063566 183.7
[M]+ 363.08835142 182.5
[M]- 363.08944858 182.5
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.