XNL
Summary
| Name: | (1~{R})-1-cyclohexyl-2-pyrido[3,4-b]indol-9-yl-ethanol |
| Formula: | C19 H22 N2 O |
| Formal charge: | 0 |
| Formula weight: | 294.391 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.4 | (1~{R})-1-cyclohexyl-2-pyrido[3,4-b]indol-9-yl-ethanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C19H22N2O/c22-19(14-6-2-1-3-7-14)13-21-17-9-5-4-8-15(17)16-10-11-20-12-18(16)21/h4-5,8-12,14,19,22H,1-3,6-7,13H2/t19-/m0/s1 |
| InChIKey | InChI | 1.03 | MMCCSFCZNUXGJD-IBGZPJMESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O[C@@H](Cn1c2ccccc2c3ccncc13)C4CCCCC4 |
| SMILES | CACTVS | 3.385 | O[CH](Cn1c2ccccc2c3ccncc13)C4CCCCC4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | c1ccc2c(c1)c3ccncc3n2C[C@@H](C4CCCCC4)O |
| SMILES | OpenEye OEToolkits | 2.0.4 | c1ccc2c(c1)c3ccncc3n2CC(C4CCCCC4)O |
