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FNP

Summary
Name:{[7-(DIFLUORO-PHOSPHONO-METHYL)-NAPHTHALEN-2-YL]-DIFLUORO-METHYL}-PHOSPHONIC ACID
Formula:C12 H10 F4 O6 P2
Formal charge:0
Formula weight:388.145 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04[naphthalene-2,7-diylbis(difluoromethanediyl)]bis(phosphonic acid)
OpenEye OEToolkits1.5.0[[7-(difluoro-phosphono-methyl)naphthalen-2-yl]-difluoro-methyl]phosphonic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04FC(F)(c1cc2c(cc1)ccc(c2)C(F)(F)P(=O)(O)O)P(=O)(O)O
SMILES_CANONICALCACTVS3.341O[P](O)(=O)C(F)(F)c1ccc2ccc(cc2c1)C(F)(F)[P](O)(O)=O
SMILESCACTVS3.341O[P](O)(=O)C(F)(F)c1ccc2ccc(cc2c1)C(F)(F)[P](O)(O)=O
SMILES_CANONICALOpenEye OEToolkits1.5.0c1cc(cc2c1ccc(c2)C(F)(F)P(=O)(O)O)C(F)(F)P(=O)(O)O
SMILESOpenEye OEToolkits1.5.0c1cc(cc2c1ccc(c2)C(F)(F)P(=O)(O)O)C(F)(F)P(=O)(O)O
InChIInChI1.03InChI=1S/C12H10F4O6P2/c13-11(14,23(17,18)19)9-3-1-7-2-4-10(6-8(7)5-9)12(15,16)24(20,21)22/h1-6H,(H2,17,18,19)(H2,20,21,22)
InChIKeyInChI1.03VHKBLEYUHBIBNR-UHFFFAOYSA-N

218196

PDB entries from 2024-04-10

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