Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | N4(c1ccc(cc1)CCN2CCCC2)CCC(N3CCCC3)CC4 |
InChI | InChI | 1.03 | InChI=1S/C21H33N3/c1-2-13-22(12-1)16-9-19-5-7-20(8-6-19)24-17-10-21(11-18-24)23-14-3-4-15-23/h5-8,21H,1-4,9-18H2 |
InChIKey | InChI | 1.03 | JPTZZWFKOIEDMU-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | C1CCN(C1)CCc2ccc(cc2)N3CCC(CC3)N4CCCC4 |
SMILES | CACTVS | 3.385 | C1CCN(C1)CCc2ccc(cc2)N3CCC(CC3)N4CCCC4 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1CCN2CCCC2)N3CCC(CC3)N4CCCC4 |
SMILES | OpenEye OEToolkits | 1.7.6 | c1cc(ccc1CCN2CCCC2)N3CCC(CC3)N4CCCC4 |