UOK

2-(5-methoxy-1~{H}-indol-3-yl)ethanenitrile

Created:2021-03-03
Last modified:  2021-06-30

Help

Find related ligands:

Chemical Details

Formal Charge0
Atom Count24
Chiral Atom Count0
Bond Count25
Aromatic Bond Count10
2D diagram of UOK

WebGL does not seem to be available.

This can be caused by an outdated browser, graphics card driver issue, or bad weather. Sometimes, just restarting the browser helps. Also, make sure hardware acceleration is enabled in your browser.

For a list of supported browsers, refer to http://caniuse.com/#feat=webgl.

Toggle HydrogenToggle Labels

Chemical Component Summary

Name2-(5-methoxy-1~{H}-indol-3-yl)ethanenitrile
Systematic Name (OpenEye OEToolkits)2-(5-methoxy-1~{H}-indol-3-yl)ethanenitrile
FormulaC11 H10 N2 O
Molecular Weight186.21
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385COc1ccc2[nH]cc(CC#N)c2c1
SMILESOpenEye OEToolkits2.0.7COc1ccc2c(c1)c(c[nH]2)CC#N
Canonical SMILESCACTVS3.385 COc1ccc2[nH]cc(CC#N)c2c1
Canonical SMILESOpenEye OEToolkits2.0.7 COc1ccc2c(c1)c(c[nH]2)CC#N
InChIInChI1.03 InChI=1S/C11H10N2O/c1-14-9-2-3-11-10(6-9)8(4-5-12)7-13-11/h2-3,6-7,13H,4H2,1H3
InChIKeyInChI1.03 ZBQCXEREMRGOCO-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 3564783
ChEMBL CHEMBL2377609
CCDC/CSD SAFYEF