Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | c1ccccc1C(C)CC(CC2N(C)CCCC2)C |
SMILES_CANONICAL | CACTVS | 3.341 | C[C@@H](C[C@@H](C)c1ccccc1)C[C@@H]2CCCCN2C |
SMILES | CACTVS | 3.341 | C[CH](C[CH](C)c1ccccc1)C[CH]2CCCCN2C |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C[C@H](C[C@@H]1CCCC[N@]1C)C[C@@H](C)c2ccccc2 |
SMILES | OpenEye OEToolkits | 1.5.0 | CC(CC1CCCCN1C)CC(C)c2ccccc2 |
InChI | InChI | 1.03 | InChI=1S/C18H29N/c1-15(14-18-11-7-8-12-19(18)3)13-16(2)17-9-5-4-6-10-17/h4-6,9-10,15-16,18H,7-8,11-14H2,1-3H3/t15-,16+,18-/m0/s1 |
InChIKey | InChI | 1.03 | UEEAJOUBQAEABH-JZXOWHBKSA-N |