Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C1NC(C(=O)NC1Cc2ccccc2)Cc3ccc(O)cc3 |
InChI | InChI | 1.03 | InChI=1S/C18H18N2O3/c21-14-8-6-13(7-9-14)11-16-18(23)19-15(17(22)20-16)10-12-4-2-1-3-5-12/h1-9,15-16,21H,10-11H2,(H,19,23)(H,20,22)/t15-,16-/m0/s1 |
InChIKey | InChI | 1.03 | GRWVBLRIPRGGPD-HOTGVXAUSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | Oc1ccc(C[C@@H]2NC(=O)[C@H](Cc3ccccc3)NC2=O)cc1 |
SMILES | CACTVS | 3.370 | Oc1ccc(C[CH]2NC(=O)[CH](Cc3ccccc3)NC2=O)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)C[C@H]2C(=O)N[C@H](C(=O)N2)Cc3ccc(cc3)O |
SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(cc1)CC2C(=O)NC(C(=O)N2)Cc3ccc(cc3)O |