GKW

1-[(4-methoxyphenyl)methyl]-~{N}-oxidanyl-indole-6-carboxamide

Created:2018-09-25
Last modified:  2018-10-31

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Chemical Details

Formal Charge0
Atom Count38
Chiral Atom Count0
Bond Count40
Aromatic Bond Count16
2D diagram of GKW

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Chemical Component Summary

Name1-[(4-methoxyphenyl)methyl]-~{N}-oxidanyl-indole-6-carboxamide
Systematic Name (OpenEye OEToolkits)1-[(4-methoxyphenyl)methyl]-~{N}-oxidanyl-indole-6-carboxamide
FormulaC17 H16 N2 O3
Molecular Weight296.321
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385COc1ccc(Cn2ccc3ccc(cc23)C(=O)NO)cc1
SMILESOpenEye OEToolkits2.0.6COc1ccc(cc1)Cn2ccc3c2cc(cc3)C(=O)NO
Canonical SMILESCACTVS3.385 COc1ccc(Cn2ccc3ccc(cc23)C(=O)NO)cc1
Canonical SMILESOpenEye OEToolkits2.0.6 COc1ccc(cc1)Cn2ccc3c2cc(cc3)C(=O)NO
InChIInChI1.03 InChI=1S/C17H16N2O3/c1-22-15-6-2-12(3-7-15)11-19-9-8-13-4-5-14(10-16(13)19)17(20)18-21/h2-10,21H,11H2,1H3,(H,18,20)
InChIKeyInChI1.03 AJRGHIGYPXNABY-UHFFFAOYSA-N

Related Resource References

Resource NameReference
Pharos CHEMBL2170177
PubChem 24753719
ChEMBL CHEMBL2170177
ChEBI CHEBI:94192