Type | Program | Version | Descriptor |
SMILES_CANONICAL | CACTVS | 3.352 | Cc1ccc(cc1)[S](=O)(=O)N[C@@H](Cc2ccccc2)C(=O)CCl |
SMILES | CACTVS | 3.352 | Cc1ccc(cc1)[S](=O)(=O)N[CH](Cc2ccccc2)C(=O)CCl |
SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | Cc1ccc(cc1)S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)CCl |
SMILES | OpenEye OEToolkits | 1.6.1 | Cc1ccc(cc1)S(=O)(=O)NC(Cc2ccccc2)C(=O)CCl |
InChI | InChI | 1.03 | InChI=1S/C17H18ClNO3S/c1-13-7-9-15(10-8-13)23(21,22)19-16(17(20)12-18)11-14-5-3-2-4-6-14/h2-10,16,19H,11-12H2,1H3/t16-/m0/s1 |
InChIKey | InChI | 1.03 | MQUQNUAYKLCRME-INIZCTEOSA-N |