VVP

4-methoxy-1H-indole

Created:2020-09-17
Last modified:  2020-09-30

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Chemical Details

Formal Charge0
Atom Count20
Chiral Atom Count0
Bond Count21
Aromatic Bond Count10
2D diagram of VVP

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Chemical Component Summary

Name4-methoxy-1H-indole
Systematic Name (OpenEye OEToolkits)4-methoxy-1~{H}-indole
FormulaC9 H9 N O
Molecular Weight147.174
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01n1ccc2c1cccc2OC
SMILESCACTVS3.385COc1cccc2[nH]ccc12
SMILESOpenEye OEToolkits2.0.7COc1cccc2c1cc[nH]2
Canonical SMILESCACTVS3.385 COc1cccc2[nH]ccc12
Canonical SMILESOpenEye OEToolkits2.0.7 COc1cccc2c1cc[nH]2
InChIInChI1.03 InChI=1S/C9H9NO/c1-11-9-4-2-3-8-7(9)5-6-10-8/h2-6,10H,1H3
InChIKeyInChI1.03 LUNOXNMCFPFPMO-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 138363
ChEMBL CHEMBL2018155