Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | C2(N(/C(=C\c1ccc(cc1)OC)C(=O)Nc3c2cccc3)C)=O |
InChI | InChI | 1.03 | InChI=1S/C18H16N2O3/c1-20-16(11-12-7-9-13(23-2)10-8-12)17(21)19-15-6-4-3-5-14(15)18(20)22/h3-11H,1-2H3,(H,19,21)/b16-11- |
InChIKey | InChI | 1.03 | MWFWGXGLRBDFOQ-WJDWOHSUSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(cc1)/C=C/2N(C)C(=O)c3ccccc3NC/2=O |
SMILES | CACTVS | 3.385 | COc1ccc(cc1)C=C2N(C)C(=O)c3ccccc3NC2=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CN1/C(=C\c2ccc(cc2)OC)/C(=O)Nc3ccccc3C1=O |
SMILES | OpenEye OEToolkits | 1.9.2 | CN1C(=Cc2ccc(cc2)OC)C(=O)Nc3ccccc3C1=O |