Systematic / IUPAC Name: 9-Chloro-4-hydroxy-5-imino-2-oxo-3H-chromeno[3,4-c]pyridine-1-carbonitrile
ID: Reference8687
Other Names:
4H-[1]Benzopyrano[3,4-c]pyridine-1-carbonitrile, 9-chloro-3,5-dihydro-2-hydroxy-5-imino-4-oxo-;
Kinome_3721
Formula: C13H6ClN3O3
9-Chloro-2-hydroxy-5-imino-4-oxo-3,5-dihydro-4H-chromeno[3,4-c]pyridine-1-carbonitrile mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Q Exactive Orbitrap |
No. of Spectral Trees | 1 |
No. of Spectra | 110 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI |
Analyzers | FT |
Last Modification | 3/8/2019 8:52:52 AM |
InChI | InChI=1S/C13H6ClN3O3/c14-5-1-2-8-6(3-5)9-7(4-15)12(18)17-13(19)10(9)11(16)20-8/h1-3,16H,(H2,17,18,19) |
InChI Key | OKCNACDPDSQZSE-UHFFFAOYSA-N |
Canonical SMILES | C1=CC2=C(C=C1Cl)C3=C(C(=O)NC(=C3C(=N)O2)O)C#N |
CAS | |
Splash | |
Other Names |
4H-[1]Benzopyrano[3,4-c]pyridine-1-carbonitrile, 9-chloro-3,5-dihydro-2-hydroxy-5-imino-4-oxo-; Kinome_3721 |
PubChem | 397107 |
ChEMBL | CHEMBL1973711 |
ChemSpider | 17922972 |