A1Z
Summary
Name: | Vadadustat |
Synonyms: | GSK128863 |
Formula: | C14 H11 Cl N2 O4 |
Formal charge: | 0 |
Formula weight: | 306.701 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 2-[[5-(3-chlorophenyl)-3-oxidanyl-pyridin-2-yl]carbonylamino]ethanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C14H11ClN2O4/c15-10-3-1-2-8(4-10)9-5-11(18)13(16-6-9)14(21)17-7-12(19)20/h1-6,18H,7H2,(H,17,21)(H,19,20) |
InChIKey | InChI | 1.03 | JGRXMPYUTJLTKT-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)CNC(=O)c1ncc(cc1O)c2cccc(Cl)c2 |
SMILES | CACTVS | 3.385 | OC(=O)CNC(=O)c1ncc(cc1O)c2cccc(Cl)c2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(cc(c1)Cl)c2cc(c(nc2)C(=O)NCC(=O)O)O |
SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(cc(c1)Cl)c2cc(c(nc2)C(=O)NCC(=O)O)O |