NWH
Summary
| Name: | N-[(2S)-heptan-2-yl]formamide |
| Synonyms: | (S)-N-1-methylhexylformamide |
| Formula: | C8 H17 N O |
| Formal charge: | 0 |
| Formula weight: | 143.227 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-[(2S)-heptan-2-yl]formamide |
| OpenEye OEToolkits | 2.0.6 | ~{N}-[(2~{S})-heptan-2-yl]methanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CCCCCC(C)NC=O |
| InChI | InChI | 1.03 | InChI=1S/C8H17NO/c1-3-4-5-6-8(2)9-7-10/h7-8H,3-6H2,1-2H3,(H,9,10)/t8-/m0/s1 |
| InChIKey | InChI | 1.03 | GFVRKPKAQHTAQK-QMMMGPOBSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCC[C@H](C)NC=O |
| SMILES | CACTVS | 3.385 | CCCCC[CH](C)NC=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCCCC[C@H](C)NC=O |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCCCCC(C)NC=O |
