XRX
Summary
| Name: | 3-(dimethylamino)butyl dimethylcarbamate |
| Formula: | C9 H20 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 188.267 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (3R)-3-(dimethylamino)butyl dimethylcarbamate |
| OpenEye OEToolkits | 1.9.2 | [(3R)-3-(dimethylamino)butyl] N,N-dimethylcarbamate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(OCCC(N(C)C)C)N(C)C |
| InChI | InChI | 1.03 | InChI=1S/C9H20N2O2/c1-8(10(2)3)6-7-13-9(12)11(4)5/h8H,6-7H2,1-5H3/t8-/m1/s1 |
| InChIKey | InChI | 1.03 | VVGQXMCHKFOTKZ-MRVPVSSYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@H](CCOC(=O)N(C)C)N(C)C |
| SMILES | CACTVS | 3.385 | C[CH](CCOC(=O)N(C)C)N(C)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C[C@H](CCOC(=O)N(C)C)N(C)C |
| SMILES | OpenEye OEToolkits | 1.9.2 | CC(CCOC(=O)N(C)C)N(C)C |
