| PDB CCD ID: | WE5 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C12 H13 N O3 |
| InChI: | InChI=1S/C12H13NO3/c1-16-12(15)9-7-11(14)13(8-9)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3/t9-/m1/s1 |
| InChIKey: | OIAHHVOKOCPNJP-SECBINFHSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 2.0.7 | COC(=O)C1CC(=O)N(C1)c2ccccc2 | | CACTVS 3.385 | COC(=O)[CH]1CN(C(=O)C1)c2ccccc2 | | CACTVS 3.385 | COC(=O)[C@H]1CN(C(=O)C1)c2ccccc2 | | ACDLabs 12.01 | O=C(OC)C1CC(=O)N(C1)c1ccccc1 | | OpenEye OEToolkits 2.0.7 | COC(=O)[C@@H]1CC(=O)N(C1)c2ccccc2 |
|
| Name: | methyl (3R)-5-oxo-1-phenylpyrrolidine-3-carboxylate |
| ZINC: | ZINC000000050103 |
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