03A
Summary
| Name: | (3S)-3-amino-N-cyclopropyl-2-oxohexanamide |
| Formula: | C9 H16 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 184.236 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (3S)-3-amino-N-cyclopropyl-2-oxohexanamide |
| OpenEye OEToolkits | 1.7.2 | 3-azanyl-N-cyclopropyl-2-oxidanylidene-hexanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(C(=O)NC1CC1)C(N)CCC |
| InChI | InChI | 1.03 | InChI=1S/C9H16N2O2/c1-2-3-7(10)8(12)9(13)11-6-4-5-6/h6-7H,2-5,10H2,1H3,(H,11,13)/t7-/m0/s1 |
| InChIKey | InChI | 1.03 | FTXZHTIVOPMXBI-ZETCQYMHSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CCC[C@H](N)C(=O)C(=O)NC1CC1 |
| SMILES | CACTVS | 3.370 | CCC[CH](N)C(=O)C(=O)NC1CC1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | CCCC(C(=O)C(=O)NC1CC1)N |
| SMILES | OpenEye OEToolkits | 1.7.2 | CCCC(C(=O)C(=O)NC1CC1)N |
