Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(Nc1cc(c(O)cc1)c2cc(ccc2O)NC(=O)C)C |
InChI | InChI | 1.03 | InChI=1S/C16H16N2O4/c1-9(19)17-11-3-5-15(21)13(7-11)14-8-12(18-10(2)20)4-6-16(14)22/h3-8,21-22H,1-2H3,(H,17,19)(H,18,20) |
InChIKey | InChI | 1.03 | PHJCCQZHFLRCAA-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1ccc(O)c(c1)c2cc(NC(C)=O)ccc2O |
SMILES | CACTVS | 3.385 | CC(=O)Nc1ccc(O)c(c1)c2cc(NC(C)=O)ccc2O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(=O)Nc1ccc(c(c1)c2cc(ccc2O)NC(=O)C)O |
SMILES | OpenEye OEToolkits | 1.7.6 | CC(=O)Nc1ccc(c(c1)c2cc(ccc2O)NC(=O)C)O |