CID 9575077

N-[(e)-(4-chlorophenyl)methyleneamino]-4-[(4-methoxybenzoyl)amino]benzamide

Structural Information

Molecular Formula
C22H18ClN3O3
SMILES
COC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)N/N=C/C3=CC=C(C=C3)Cl
InChI
InChI=1S/C22H18ClN3O3/c1-29-20-12-6-16(7-13-20)21(27)25-19-10-4-17(5-11-19)22(28)26-24-14-15-2-8-18(23)9-3-15/h2-14H,1H3,(H,25,27)(H,26,28)/b24-14+
InChIKey
RVXNPMRHQGYSLX-ZVHZXABRSA-N
Compound name
N-[(E)-(4-chlorophenyl)methylideneamino]-4-[(4-methoxybenzoyl)amino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

407.10367 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 408.11095 196.8
[M+Na]+ 430.09289 202.6
[M-H]- 406.09639 207.5
[M+NH4]+ 425.13749 207.4
[M+K]+ 446.06683 197.0
[M+H-H2O]+ 390.10093 186.8
[M+HCOO]- 452.10187 218.9
[M+CH3COO]- 466.11752 230.2
[M+Na-2H]- 428.07834 199.9
[M]+ 407.10312 200.2
[M]- 407.10422 200.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.