CID 211485

23205-23-4

Structural Information

Molecular Formula
C20H24ClN3O3
SMILES
C1COCCN1CCNC(=O)C2=CC(=C(C=C2OCC3=CC=CC=C3)N)Cl
InChI
InChI=1S/C20H24ClN3O3/c21-17-12-16(20(25)23-6-7-24-8-10-26-11-9-24)19(13-18(17)22)27-14-15-4-2-1-3-5-15/h1-5,12-13H,6-11,14,22H2,(H,23,25)
InChIKey
BYILAFYHQWADTR-UHFFFAOYSA-N
Compound name
4-amino-5-chloro-N-(2-morpholin-4-ylethyl)-2-phenylmethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

389.1506 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 390.15788 194.0
[M+Na]+ 412.13982 197.9
[M-H]- 388.14332 201.2
[M+NH4]+ 407.18442 202.0
[M+K]+ 428.11376 193.2
[M+H-H2O]+ 372.14786 183.7
[M+HCOO]- 434.14880 207.7
[M+CH3COO]- 448.16445 222.1
[M+Na-2H]- 410.12527 195.2
[M]+ 389.15005 193.4
[M]- 389.15115 193.4
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