Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)Cc3cc1c(Nc2c(C(=O)N1)ccc(Cl)c2)cc3 |
InChI | InChI | 1.03 | InChI=1S/C15H11ClN2O3/c16-9-2-3-10-12(7-9)17-11-4-1-8(6-14(19)20)5-13(11)18-15(10)21/h1-5,7,17H,6H2,(H,18,21)(H,19,20) |
InChIKey | InChI | 1.03 | MFBFXFHWNXYFCJ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | OC(=O)Cc1ccc2Nc3cc(Cl)ccc3C(=O)Nc2c1 |
SMILES | CACTVS | 3.370 | OC(=O)Cc1ccc2Nc3cc(Cl)ccc3C(=O)Nc2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc2c(cc1CC(=O)O)NC(=O)c3ccc(cc3N2)Cl |
SMILES | OpenEye OEToolkits | 1.7.6 | c1cc2c(cc1CC(=O)O)NC(=O)c3ccc(cc3N2)Cl |