G60
Summary
Name: | 2-(5-chloro-2-methyl-1H-indol-3-yl)ethan-1-amine |
Formula: | C11 H13 Cl N2 |
Formal charge: | 0 |
Formula weight: | 208.687 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 2-(5-chloranyl-2-methyl-1~{H}-indol-3-yl)ethanamine |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C11H13ClN2/c1-7-9(4-5-13)10-6-8(12)2-3-11(10)14-7/h2-3,6,14H,4-5,13H2,1H3 |
InChIKey | InChI | 1.03 | PPPQHAMKVHECAL-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1[nH]c2ccc(Cl)cc2c1CCN |
SMILES | CACTVS | 3.385 | Cc1[nH]c2ccc(Cl)cc2c1CCN |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1c(c2cc(ccc2[nH]1)Cl)CCN |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1c(c2cc(ccc2[nH]1)Cl)CCN |