CID 112612

2-naphthalenecarboxamide, 4-[[4-(diethylamino)-2-methylphenyl]imino]-1,4-dihydro-n-(3-methoxyphenyl)-1-oxo-

Structural Information

Molecular Formula
C29H29N3O3
SMILES
CCN(CC)C1=CC(=C(C=C1)N=C2C=C(C(=O)C3=CC=CC=C32)C(=O)NC4=CC(=CC=C4)OC)C
InChI
InChI=1S/C29H29N3O3/c1-5-32(6-2)21-14-15-26(19(3)16-21)31-27-18-25(28(33)24-13-8-7-12-23(24)27)29(34)30-20-10-9-11-22(17-20)35-4/h7-18H,5-6H2,1-4H3,(H,30,34)
InChIKey
FXGASGIURLCREU-UHFFFAOYSA-N
Compound name
4-[4-(diethylamino)-2-methylphenyl]imino-N-(3-methoxyphenyl)-1-oxonaphthalene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

467.2209 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 468.22818 217.4
[M+Na]+ 490.21012 222.1
[M-H]- 466.21362 229.8
[M+NH4]+ 485.25472 226.3
[M+K]+ 506.18406 217.8
[M+H-H2O]+ 450.21816 205.1
[M+HCOO]- 512.21910 240.7
[M+CH3COO]- 526.23475 252.1
[M+Na-2H]- 488.19557 217.7
[M]+ 467.22035 220.5
[M]- 467.22145 220.5
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.