PZZ
Summary
| Name: | 3-{3-[(DIMETHYLAMINO)METHYL]-1H-INDOL-7-YL}PROPAN-1-OL |
| Formula: | C14 H20 N2 O |
| Formal charge: | 0 |
| Formula weight: | 232.321 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 3-{3-[(dimethylamino)methyl]-1H-indol-7-yl}propan-1-ol |
| OpenEye OEToolkits | 1.5.0 | 3-[3-(dimethylaminomethyl)-1H-indol-7-yl]propan-1-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | OCCCc1cccc2c1ncc2CN(C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CN(C)Cc1c[nH]c2c(CCCO)cccc12 |
| SMILES | CACTVS | 3.341 | CN(C)Cc1c[nH]c2c(CCCO)cccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CN(C)Cc1c[nH]c2c1cccc2CCCO |
| SMILES | OpenEye OEToolkits | 1.5.0 | CN(C)Cc1c[nH]c2c1cccc2CCCO |
| InChI | InChI | 1.03 | InChI=1S/C14H20N2O/c1-16(2)10-12-9-15-14-11(6-4-8-17)5-3-7-13(12)14/h3,5,7,9,15,17H,4,6,8,10H2,1-2H3 |
| InChIKey | InChI | 1.03 | KKQDXWHOFSMCSA-UHFFFAOYSA-N |
