91Q
Summary
Name: | 3-[2-(dimethylamino)ethyl]-1~{H}-indol-4-ol |
Formula: | C12 H16 N2 O |
Formal charge: | 0 |
Formula weight: | 204.268 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 3-[2-(dimethylamino)ethyl]-1~{H}-indol-4-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C12H16N2O/c1-14(2)7-6-9-8-13-10-4-3-5-11(15)12(9)10/h3-5,8,13,15H,6-7H2,1-2H3 |
InChIKey | InChI | 1.03 | SPCIYGNTAMCTRO-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CN(C)CCc1c[nH]c2cccc(O)c12 |
SMILES | CACTVS | 3.385 | CN(C)CCc1c[nH]c2cccc(O)c12 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CN(C)CCc1c[nH]c2c1c(ccc2)O |
SMILES | OpenEye OEToolkits | 2.0.7 | CN(C)CCc1c[nH]c2c1c(ccc2)O |