Index	SMILES	Probability	Label
Compound_1	CCCCC(COC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)CC	0.97	1.0
Compound_2	CC(CCCCCOC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)C	0.92	1.0
Compound_3	CCCC(c1ccccc1)C(COC(=O)/C(=C/c1ccccc1)/C#N)CC	0.97	1.0
Compound_4	CCCCCCCCOC(=O)C(=C(c1ccccc1)c1ccccc1)C#N	0.96	1.0
Compound_5	CCCCCC(OC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)CC	0.93	1.0
Compound_6	CCCCC(COC(=O)C(=C(c1ccc(cc1)OC)c1ccccc1)C#N)CC	0.89	1.0
Compound_7	CCCCCCCCCCCCCCCCOC(=O)C(=Cc1ccc(cc1)C)C#N	0.95	1.0
Compound_8	CCCCCCOC(=O)[C](=C(c1ccccc1)c1ccccc1)(C#N)CC	0.94	1.0
Compound_9	CCCCC(COC(=O)/C(=C(/c1ccc(cc1)OC)\c1ccccc1)/C#N)CC	0.89	1.0
Compound_10	CCCCC(c1ccccc1)(COC(=O)/C(=C/c1ccccc1)/C#N)CC	0.88	1.0
Compound_11	CCCCCCOC(=O)C(=C(c1ccccc1)c1ccccc1)C#N	0.96	1.0
Compound_12	CC(OC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)CCCCCC(C)C	0.59	1.0
Compound_13	CCCC(c1ccccc1)CC(OC(=O)/C(=C/c1ccccc1)/C#N)CC	0.93	1.0
Compound_14	CCCCCCCCOC(=O)/C(=C(/c1ccc(cc1)OC)\c1ccccc1)/C#N	0.9	1.0
Compound_15	CCCCC(COC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)CCCC	0.97	1.0
Compound_16	CCCC(c1ccccc1)C(COC(=O)C(=Cc1ccccc1)C#N)CC	0.97	1.0
Compound_17	CCCCC(COC(=O)/C(=C(\c1ccc(cc1)F)/c1ccccc1)/C#N)CC	0.87	1.0
Compound_18	CCCCC(COC(=O)/C(=C(\c1ccc(cc1)c1ccccc1)/c1ccccc1)/C#N)CC	0.96	1.0
Compound_19	CCCCC(c1ccccc1)(COC(=O)[C](=C)(c1ccccc1)C#N)CC	0.91	1.0
Compound_20	CCCCCCOC(=O)/C(=C(\c1ccccc1CC)/c1ccccc1)/C#N	0.85	1.0
Compound_21	CCCCCC(OC(=O)/C(=C(/c1ccc(cc1)OC)\c1ccccc1)/C#N)CC	0.87	1.0
Compound_22	CCCCOC(=O)C(=[C](c1ccccc1)(OC)C)C#N	0.77	1.0
Compound_23	CCCCC(COC(=O)/C(=C(\c1ccc(cc1)Cl)/c1ccccc1)/C#N)CC	0.86	1.0
Compound_24	CCCCC(COC(=O)C(=C(c1ccc(cc1)C)c1ccc(cc1)C)C#N)CC	0.91	1.0
Compound_25	CCCC[C@@H](COC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)CC	0.97	1.0
Compound_26	CCCCC(COC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)CC	0.97	1.0
Compound_27	CCCCCCCCCCCCCCCCOC(=O)/C(=C/c1ccc(cc1)C)/C#N	0.95	1.0
Compound_28	CCCCCCCCOC(=O)C(=C(c1ccc(cc1)OC)c1ccccc1)C#N	0.9	1.0
Compound_29	CCC(CCCCOC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)C	0.95	1.0
Compound_30	CCCCC(COC(=O)/C(=C(\c1ccc(c(c1)C)C)/c1ccc(cc1)OC)/C#N)CC	0.81	1.0
Compound_31	CCCCC(COC(=O)/C(=C(\c1ccc(c(c1)C)C)/c1ccccc1)/C#N)CC	0.89	1.0
Compound_32	CCCCOC(=O)C(=C(c1ccccc1)c1ccccc1)C#N	0.98	1.0
Compound_33	CCCCCCOC(=O)/C(=C/c1ccc(cc1)OC)/C#N	0.86	1.0
Compound_34	CCCCCC(OC(=O)C(=C(c1ccccc1OC)c1ccccc1)C#N)CC	0.76	1.0
Compound_35	CCCCC(COC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)C	0.97	1.0
Compound_36	CCCCC(COC(=O)/C(=C/C=C/c1ccccc1)/C#N)CC	0.84	1.0
Compound_37	CCCCC(COC(=O)/C(=C/c1ccccc1)/C#N)CC	0.91	1.0
Compound_38	CCCCCCC(COC(=O)/C(=C(/c1ccc(cc1)OC)\c1ccccc1)/C#N)CCCC	0.89	1.0
Compound_39	CCCCC(COC(=O)C(=C(c1ccccc1)c1ccccc1)C#N)CC	0.97	1.0