Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C1NC(C(=O)NC1Cc2ccc(O)cc2)Cc3ccc(O)cc3 |
SMILES_CANONICAL | CACTVS | 3.341 | Oc1ccc(C[C@@H]2NC(=O)[C@H](Cc3ccc(O)cc3)NC2=O)cc1 |
SMILES | CACTVS | 3.341 | Oc1ccc(C[CH]2NC(=O)[CH](Cc3ccc(O)cc3)NC2=O)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1C[C@H]2C(=O)N[C@H](C(=O)N2)Cc3ccc(cc3)O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1CC2C(=O)NC(C(=O)N2)Cc3ccc(cc3)O)O |
InChI | InChI | 1.03 | InChI=1S/C18H18N2O4/c21-13-5-1-11(2-6-13)9-15-17(23)20-16(18(24)19-15)10-12-3-7-14(22)8-4-12/h1-8,15-16,21-22H,9-10H2,(H,19,24)(H,20,23)/t15-,16-/m0/s1 |
InChIKey | InChI | 1.03 | NGPCLOGFGKJCBP-HOTGVXAUSA-N |