CID 82416

10155-49-4

Structural Information

Molecular Formula
C19H24N2O4
SMILES
COC1=CC2=CC(=C(C=C2C=C1)O)C(=O)NCCCN3CCOCC3
InChI
InChI=1S/C19H24N2O4/c1-24-16-4-3-14-13-18(22)17(12-15(14)11-16)19(23)20-5-2-6-21-7-9-25-10-8-21/h3-4,11-13,22H,2,5-10H2,1H3,(H,20,23)
InChIKey
LVWUUYNJAWJGTF-UHFFFAOYSA-N
Compound name
3-hydroxy-7-methoxy-N-(3-morpholin-4-ylpropyl)naphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

54
Patents

344.1736 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.180876 181.8
[M+Na]+ 367.162818 185.7
[M-H]- 343.166324 186.2
[M+NH4]+ 362.207423 192.0
[M+K]+ 383.136758 182.9
[M+H-H2O]+ 327.170860 172.2
[M+HCOO]- 389.171801 197.1
[M+CH3COO]- 403.187451 212.5
[M+Na-2H]- 365.148266 185.0
[M]+ 344.17305142 181.1
[M]- 344.17414858 181.1
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