Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C16H18N2O6/c1-21-11-5-4-9(13(22-2)14(11)23-3)10-8-16(24-18-10)7-6-12(19)17-15(16)20/h4-5H,6-8H2,1-3H3,(H,17,19,20)/t16-/m0/s1 |
InChIKey | InChI | 1.06 | RKTBPSUWUCWUFM-INIZCTEOSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(C2=NO[C@@]3(CCC(=O)NC3=O)C2)c(OC)c1OC |
SMILES | CACTVS | 3.385 | COc1ccc(C2=NO[C]3(CCC(=O)NC3=O)C2)c(OC)c1OC |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccc(c(c1OC)OC)C2=NO[C@]3(C2)CCC(=O)NC3=O |
SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc(c(c1OC)OC)C2=NOC3(C2)CCC(=O)NC3=O |