CID 747008

N-[(2-oxo(1h-benzo[d]azolin-3-ylidene))azamethyl]-2-(phenylcarbonylamino)aceta mide

Structural Information

Molecular Formula
C17H14N4O3
SMILES
C1=CC=C(C=C1)C(=O)NCC(=O)N=NC2=C(NC3=CC=CC=C32)O
InChI
InChI=1S/C17H14N4O3/c22-14(10-18-16(23)11-6-2-1-3-7-11)20-21-15-12-8-4-5-9-13(12)19-17(15)24/h1-9,19,24H,10H2,(H,18,23)
InChIKey
WAIUEFMKSYEDQG-UHFFFAOYSA-N
Compound name
N-[2-[(2-hydroxy-1H-indol-3-yl)diazenyl]-2-oxoethyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

322.1066 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.11388 173.3
[M+Na]+ 345.09582 184.0
[M+NH4]+ 340.14042 179.2
[M+K]+ 361.06976 180.1
[M-H]- 321.09932 177.1
[M+Na-2H]- 343.08127 180.4
[M]+ 322.10605 175.4
[M]- 322.10715 175.4
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.