WKM
Summary
| Name: | (2S)-2-amino-3-methyl-1-(morpholin-4-yl)butan-1-one |
| Formula: | C9 H18 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 186.251 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2S)-2-amino-3-methyl-1-(morpholin-4-yl)butan-1-one |
| OpenEye OEToolkits | 2.0.7 | (2~{S})-2-azanyl-3-methyl-1-morpholin-4-yl-butan-1-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C1OCCN(C(C(C(C)C)N)=O)C1 |
| InChI | InChI | 1.03 | InChI=1S/C9H18N2O2/c1-7(2)8(10)9(12)11-3-5-13-6-4-11/h7-8H,3-6,10H2,1-2H3/t8-/m0/s1 |
| InChIKey | InChI | 1.03 | GUDFDFVIXKMPIB-QMMMGPOBSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)[C@H](N)C(=O)N1CCOCC1 |
| SMILES | CACTVS | 3.385 | CC(C)[CH](N)C(=O)N1CCOCC1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)[C@@H](C(=O)N1CCOCC1)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)C(C(=O)N1CCOCC1)N |
