Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C2NC(=O)CN(CC(N1CC(=O)NC(=O)C1)C)C2 |
SMILES_CANONICAL | CACTVS | 3.341 | C[C@H](CN1CC(=O)NC(=O)C1)N2CC(=O)NC(=O)C2 |
SMILES | CACTVS | 3.341 | C[CH](CN1CC(=O)NC(=O)C1)N2CC(=O)NC(=O)C2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@H](CN1CC(=O)NC(=O)C1)N2CC(=O)NC(=O)C2 |
SMILES | OpenEye OEToolkits | 1.5.0 | CC(CN1CC(=O)NC(=O)C1)N2CC(=O)NC(=O)C2 |
InChI | InChI | 1.03 | InChI=1S/C11H16N4O4/c1-7(15-5-10(18)13-11(19)6-15)2-14-3-8(16)12-9(17)4-14/h7H,2-6H2,1H3,(H,12,16,17)(H,13,18,19)/t7-/m1/s1 |
InChIKey | InChI | 1.03 | BMKDZUISNHGIBY-SSDOTTSWSA-N |