OCK
Summary
| Name: | (3~{R})-4-ethyl-3-methyl-3-propyl-1~{H}-1,4-benzodiazepine-2,5-dione |
| Formula: | C15 H20 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 260.331 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (3~{R})-4-ethyl-3-methyl-3-propyl-1~{H}-1,4-benzodiazepine-2,5-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H20N2O2/c1-4-10-15(3)14(19)16-12-9-7-6-8-11(12)13(18)17(15)5-2/h6-9H,4-5,10H2,1-3H3,(H,16,19)/t15-/m1/s1 |
| InChIKey | InChI | 1.03 | QTYBGLRTPWRNRA-OAHLLOKOSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCC[C@@]1(C)N(CC)C(=O)c2ccccc2NC1=O |
| SMILES | CACTVS | 3.385 | CCC[C]1(C)N(CC)C(=O)c2ccccc2NC1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCC[C@@]1(C(=O)Nc2ccccc2C(=O)N1CC)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCC1(C(=O)Nc2ccccc2C(=O)N1CC)C |
