WV8
Summary
| Name: | (2R,4S)-4-[(2S)-2-phenylbutyl]-1,3-oxazolidin-2-amine |
| Formula: | C13 H18 N2 O |
| Formal charge: | 0 |
| Formula weight: | 218.295 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (4S)-4-[(2S)-2-phenylbutyl]-4,5-dihydro-1,3-oxazol-2-amine |
| OpenEye OEToolkits | 2.0.7 | (4~{S})-4-[(2~{S})-2-phenylbutyl]-4,5-dihydro-1,3-oxazol-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CCC(CC1N=C(N)OC1)c1ccccc1 |
| InChI | InChI | 1.06 | InChI=1S/C13H18N2O/c1-2-10(11-6-4-3-5-7-11)8-12-9-16-13(14)15-12/h3-7,10,12H,2,8-9H2,1H3,(H2,14,15)/t10-,12-/m0/s1 |
| InChIKey | InChI | 1.06 | IXDKFUBXESWHSL-JQWIXIFHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC[C@@H](C[C@H]1COC(=N1)N)c2ccccc2 |
| SMILES | CACTVS | 3.385 | CC[CH](C[CH]1COC(=N1)N)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC[C@@H](C[C@H]1COC(=N1)N)c2ccccc2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCC(CC1COC(=N1)N)c2ccccc2 |
