PDB CCD ID: | 205 |
Number of entries in BioLiP: | 2 |
Chemical formula: | C14 H7 Cl2 N O3 |
InChI: | InChI=1S/C14H7Cl2NO3/c15-8-2-1-3-9(16)12(8)13-17-10-5-4-7(14(18)19)6-11(10)20-13/h1-6H,(H,18,19) |
InChIKey: | XVNRKPCHMYOPPL-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
---|
CACTVS 3.341 | OC(=O)c1ccc2nc(oc2c1)c3c(Cl)cccc3Cl | ACDLabs 10.04 | Clc3cccc(Cl)c3c1nc2ccc(cc2o1)C(=O)O | OpenEye OEToolkits 1.5.0 | c1cc(c(c(c1)Cl)c2nc3ccc(cc3o2)C(=O)O)Cl |
|
Name: | 2-(2,6-DICHLOROPHENYL)-1,3-BENZOXAZOLE-6-CARBOXYLIC ACID |
ChEMBL: | CHEMBL1229789 |
DrugBank: | DB06907 |