MVW
Summary
| Name: | 5,7-dimethyl-4-[[(2~{S})-2-phenylpiperidin-1-yl]methyl]-1~{H}-indole |
| Formula: | C22 H26 N2 |
| Formal charge: | 0 |
| Formula weight: | 318.455 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5,7-dimethyl-4-[[(2~{S})-2-phenylpiperidin-1-yl]methyl]-1~{H}-indole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C22H26N2/c1-16-14-17(2)22-19(11-12-23-22)20(16)15-24-13-7-6-10-21(24)18-8-4-3-5-9-18/h3-5,8-9,11-12,14,21,23H,6-7,10,13,15H2,1-2H3/t21-/m0/s1 |
| InChIKey | InChI | 1.03 | GRJUTCRGMYGLQC-NRFANRHFSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cc(C)c2[nH]ccc2c1CN3CCCC[C@H]3c4ccccc4 |
| SMILES | CACTVS | 3.385 | Cc1cc(C)c2[nH]ccc2c1CN3CCCC[CH]3c4ccccc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(c2c(c1CN3CCCC[C@H]3c4ccccc4)cc[nH]2)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(c2c(c1CN3CCCCC3c4ccccc4)cc[nH]2)C |
