Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | C2(NC(Cc1ccccc1)C(=O)Nc3c2cccc3)=O |
InChI | InChI | 1.03 | InChI=1S/C16H14N2O2/c19-15-12-8-4-5-9-13(12)17-16(20)14(18-15)10-11-6-2-1-3-7-11/h1-9,14H,10H2,(H,17,20)(H,18,19)/t14-/m0/s1 |
InChIKey | InChI | 1.03 | IOYQGXYNQRRATP-AWEZNQCLSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | O=C1Nc2ccccc2C(=O)N[C@H]1Cc3ccccc3 |
SMILES | CACTVS | 3.385 | O=C1Nc2ccccc2C(=O)N[CH]1Cc3ccccc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1ccc(cc1)C[C@H]2C(=O)Nc3ccccc3C(=O)N2 |
SMILES | OpenEye OEToolkits | 1.9.2 | c1ccc(cc1)CC2C(=O)Nc3ccccc3C(=O)N2 |