GBK
Summary
| Name: | (2~{S},3~{S})-~{N}-[(2-methoxyphenyl)methyl]-2-phenyl-piperidin-3-amine |
| Formula: | C19 H24 N2 O |
| Formal charge: | 0 |
| Formula weight: | 296.407 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | (2~{S},3~{S})-~{N}-[(2-methoxyphenyl)methyl]-2-phenyl-piperidin-3-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C19H24N2O/c1-22-18-12-6-5-10-16(18)14-21-17-11-7-13-20-19(17)15-8-3-2-4-9-15/h2-6,8-10,12,17,19-21H,7,11,13-14H2,1H3/t17-,19-/m0/s1 |
| InChIKey | InChI | 1.03 | DTQNEFOKTXXQKV-HKUYNNGSSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccccc1CN[C@H]2CCCN[C@H]2c3ccccc3 |
| SMILES | CACTVS | 3.385 | COc1ccccc1CN[CH]2CCCN[CH]2c3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COc1ccccc1CN[C@H]2CCCN[C@H]2c3ccccc3 |
| SMILES | OpenEye OEToolkits | 2.0.6 | COc1ccccc1CNC2CCCNC2c3ccccc3 |
