PDB CCD ID: | XZX |
Number of entries in BioLiP: | 2 |
Chemical formula: | C9 H9 Cl2 N O2 |
InChI: | InChI=1S/C9H9Cl2NO2/c1-5(13)9(14)12-8-3-6(10)2-7(11)4-8/h2-5,13H,1H3,(H,12,14)/t5-/m0/s1 |
InChIKey: | ZJXPSNBSBSJSOE-YFKPBYRVSA-N |
SMILES: | Software | SMILES |
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OpenEye OEToolkits 2.0.7 | C[C@@H](C(=O)Nc1cc(cc(c1)Cl)Cl)O | CACTVS 3.385 | C[C@H](O)C(=O)Nc1cc(Cl)cc(Cl)c1 | ACDLabs 12.01 | Clc1cc(NC(=O)C(C)O)cc(Cl)c1 | CACTVS 3.385 | C[CH](O)C(=O)Nc1cc(Cl)cc(Cl)c1 | OpenEye OEToolkits 2.0.7 | CC(C(=O)Nc1cc(cc(c1)Cl)Cl)O |
|
Name: | (2S)-N-(3,5-dichlorophenyl)-2-hydroxypropanamide |