[7-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-1,1-bis(fluoranyl)heptyl]-ethoxy-phosphinic acid

Systemtic Name: [7-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-1,1-bis(fluoranyl)heptyl]-ethoxy-phosphinic acid Openeye Name: [7-(2-amino-6-oxo-3H-purin-9-yl)-1,1-difluoro-heptyl]-ethoxy-phosphinic acid CAS Name: [7-(2-amino-6-oxo-3H-purin-9-yl)-1,1-difluoroheptyl]-ethoxyphosphinic acid IUPAC Name: [7-(2-amino-6-oxo-3H-purin-9-yl)-1,1-difluoroheptyl]-ethoxyphosphinic acid Traditional Name: [7-(2-amino-6-keto-3H-purin-9-yl)-1,1-difluoro-heptyl]-ethoxy-phosphinic acid Formula: C14H22F2N5O4P MolecularWeight: 393.326147

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CCCCCCN1C=NC2=C1NC(=NC2=O)N)(F)F)O

Isomeric SMILES

CCOP(=O)(C(CCCCCCN1C=NC2=C1NC(=NC2=O)N)(F)F)O

InChI

InChI=1S/C14H22F2N5O4P/c1-2-25-26(23,24)14(15,16)7-5-3-4-6-8-21-9-18-10-11(21)19-13(17)20-12(10)22/h9H,2-8H2,1H3,(H,23,24)(H3,17,19,20,22)