A87
Summary
| Name: | 3-[2-[butyl(2-cycloheptylethyl)amino]ethyl]-1~{H}-indol-6-ol |
| Formula: | C23 H36 N2 O |
| Formal charge: | 0 |
| Formula weight: | 356.545 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3-[2-[butyl(2-cycloheptylethyl)amino]ethyl]-1~{H}-indol-6-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C23H36N2O/c1-2-3-14-25(15-12-19-8-6-4-5-7-9-19)16-13-20-18-24-23-17-21(26)10-11-22(20)23/h10-11,17-19,24,26H,2-9,12-16H2,1H3 |
| InChIKey | InChI | 1.03 | KRICXPIAKQTZMM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCN(CCC1CCCCCC1)CCc2c[nH]c3cc(O)ccc23 |
| SMILES | CACTVS | 3.385 | CCCCN(CCC1CCCCCC1)CCc2c[nH]c3cc(O)ccc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCN(CCc1c[nH]c2c1ccc(c2)O)CCC3CCCCCC3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCN(CCc1c[nH]c2c1ccc(c2)O)CCC3CCCCCC3 |
