FYE

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Summary

Name:6-fluoranyl-~{N}-[(1-oxidanylcyclohexyl)methyl]-4-oxidanylidene-chromene-2-carboxamide
Formula:C17 H18 F N O4
Formal charge:0
Molecular weight:319.328 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.66-fluoranyl-~{N}-[(1-oxidanylcyclohexyl)methyl]-4-oxidanylidene-chromene-2-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C17H18FNO4/c18-11-4-5-14-12(8-11)13(20)9-15(23-14)16(21)19-10-17(22)6-2-1-3-7-17/h4-5,8-9,22H,1-3,6-7,10H2,(H,19,21)
InChIKeyInChI1.03PHMBHONIMDVOKO-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385OC1(CCCCC1)CNC(=O)C2=CC(=O)c3cc(F)ccc3O2
SMILESCACTVS3.385OC1(CCCCC1)CNC(=O)C2=CC(=O)c3cc(F)ccc3O2
SMILES_CANONICALOpenEye OEToolkits2.0.6c1cc2c(cc1F)C(=O)C=C(O2)C(=O)NCC3(CCCCC3)O
SMILESOpenEye OEToolkits2.0.6c1cc2c(cc1F)C(=O)C=C(O2)C(=O)NCC3(CCCCC3)O