CXI
Summary
Name: | 2-(3-phenyloxetan-3-yl)ethanamine |
Formula: | C11 H15 N O |
Formal charge: | 0 |
Formula weight: | 177.243 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 2-(3-phenyloxetan-3-yl)ethanamine |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C11H15NO/c12-7-6-11(8-13-9-11)10-4-2-1-3-5-10/h1-5H,6-9,12H2 |
InChIKey | InChI | 1.03 | WOFYQYBPLNLJAS-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | NCCC1(COC1)c2ccccc2 |
SMILES | CACTVS | 3.385 | NCCC1(COC1)c2ccccc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)C2(COC2)CCN |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)C2(COC2)CCN |