PDB CCD ID: | 46O |
Number of entries in BioLiP: | 2 |
Chemical formula: | C12 H15 N O2 |
InChI: | InChI=1S/C12H15NO2/c1-2-10(13-5-1)9-3-4-11-12(8-9)15-7-6-14-11/h3-4,8,10,13H,1-2,5-7H2/t10-/m1/s1 |
InChIKey: | LSNPFVDQLTUQCE-SNVBAGLBSA-N |
SMILES: | Software | SMILES |
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OpenEye OEToolkits 1.9.2 | c1cc2c(cc1[C@H]3CCCN3)OCCO2 | OpenEye OEToolkits 1.9.2 | c1cc2c(cc1C3CCCN3)OCCO2 | CACTVS 3.385 | C1CN[C@H](C1)c2ccc3OCCOc3c2 | CACTVS 3.385 | C1CN[CH](C1)c2ccc3OCCOc3c2 | ACDLabs 12.01 | O1c2c(OCC1)cc(cc2)C3NCCC3 |
|
Name: | (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidine |
ZINC: | ZINC000002534012 |