PDB CCD ID: | A1LX4 |
Number of entries in BioLiP: | 4 |
Chemical formula: | C17 H21 N O |
InChI: | InChI=1S/C17H21NO/c1-14-8-6-7-11-16(14)19-17(12-13-18-2)15-9-4-3-5-10-15/h3-11,17-18H,12-13H2,1-2H3/t17-/m1/s1 |
InChIKey: | VHGCDTVCOLNTBX-QGZVFWFLSA-N |
SMILES: | Software | SMILES |
---|
CACTVS 3.385 | CNCC[CH](Oc1ccccc1C)c2ccccc2 | CACTVS 3.385 | CNCC[C@@H](Oc1ccccc1C)c2ccccc2 | OpenEye OEToolkits 2.0.7 | Cc1ccccc1O[C@H](CCNC)c2ccccc2 | OpenEye OEToolkits 2.0.7 | Cc1ccccc1OC(CCNC)c2ccccc2 |
|
Name: | (3R)-N-methyl-3-(2-methylphenoxy)-3-phenyl-propan-1-amine; Atomoxetine |