X0G
概要
表記: | 4-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]morpholine |
組成式: | C10 H15 N3 O2 |
電荷: | 0 |
化学式量: | 209.245 Da |
分子種別: | non-polymer |
化合物名
プログラム | バージョン | 表記 |
ACDLabs | 12.01 | 4-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]morpholine |
OpenEye OEToolkits | 2.0.7 | 4-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]morpholine |
化合物記述子(線形表記)
種別 | プログラム | バージョン | 表記 |
SMILES | ACDLabs | 12.01 | C3N(Cc1nc(no1)C2CC2)CCOC3 |
InChI | InChI | 1.03 | InChI=1S/C10H15N3O2/c1-2-8(1)10-11-9(15-12-10)7-13-3-5-14-6-4-13/h8H,1-7H2 |
InChIKey | InChI | 1.03 | PAJXOLYFZZURHI-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | C1CN(CCO1)Cc2onc(n2)C3CC3 |
SMILES | CACTVS | 3.385 | C1CN(CCO1)Cc2onc(n2)C3CC3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1CC1c2nc(on2)CN3CCOCC3 |
SMILES | OpenEye OEToolkits | 2.0.7 | C1CC1c2nc(on2)CN3CCOCC3 |