Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | [N@H]=C(N)c2ccc1cc(ccc1c2)C4OC4c3ccccc3 |
InChI | InChI | 1.03 | InChI=1S/C19H16N2O/c20-19(21)16-9-7-13-10-15(8-6-14(13)11-16)18-17(22-18)12-4-2-1-3-5-12/h1-11,17-18H,(H3,20,21)/t17-,18-/m0/s1 |
InChIKey | InChI | 1.03 | RZYGGGSOUBZFKW-ROUUACIJSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | NC(=N)c1ccc2cc(ccc2c1)[C@@H]3O[C@H]3c4ccccc4 |
SMILES | CACTVS | 3.370 | NC(=N)c1ccc2cc(ccc2c1)[CH]3O[CH]3c4ccccc4 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | [H]/N=C(/c1ccc2cc(ccc2c1)[C@H]3[C@@H](O3)c4ccccc4)\N |
SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)C2C(O2)c3ccc4cc(ccc4c3)C(=N)N |