PDB CCD ID: | 9BC |
Number of entries in BioLiP: | 1 |
Chemical formula: | C21 H22 N2 O3 |
InChI: | InChI=1S/C21H22N2O3/c24-21(25)19-12-7-13-23(16-19)14-15-26-22-20(17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-6,8-12H,7,13-16H2,(H,24,25) |
InChIKey: | NGNALWDRPKNJGR-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
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CACTVS 3.385 | OC(=O)C1=CCCN(CCON=C(c2ccccc2)c3ccccc3)C1 | OpenEye OEToolkits 2.0.7 | c1ccc(cc1)C(=NOCCN2CCC=C(C2)C(=O)O)c3ccccc3 |
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Name: | 1-(2-{[(diphenylmethylidene)amino]oxy}ethyl)-1,2,5,6-tetrahydropyridine-3-carboxylic acid; NO-711 |
ChEMBL: | CHEMBL473104 |
ZINC: | ZINC000001534967 |