2-(6-aminopurin-9-yl)ethoxymethyl-[2,2-bis(fluoranyl)-3-oxidanyl-propoxy]phosphinic acid

Systemtic Name: 2-(6-aminopurin-9-yl)ethoxymethyl-[2,2-bis(fluoranyl)-3-oxidanyl-propoxy]phosphinic acid Openeye Name: 2-(6-aminopurin-9-yl)ethoxymethyl-(2,2-difluoro-3-hydroxy-propoxy)phosphinic acid CAS Name: 2-(6-aminopurin-9-yl)ethoxymethyl-(2,2-difluoro-3-hydroxypropoxy)phosphinic acid IUPAC Name: 2-(6-aminopurin-9-yl)ethoxymethyl-(2,2-difluoro-3-hydroxypropoxy)phosphinic acid Traditional Name: 2-adenin-9-ylethoxymethyl-(2,2-difluoro-3-hydroxy-propoxy)phosphinic acid Formula: C11H16F2N5O5P MolecularWeight: 367.245807

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2CCOCP(=O)(O)OCC(CO)(F)F

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2CCOCP(=O)(O)OCC(CO)(F)F

InChI

InChI=1S/C11H16F2N5O5P/c12-11(13,3-19)4-23-24(20,21)7-22-2-1-18-6-17-8-9(14)15-5-16-10(8)18/h5-6,19H,1-4,7H2,(H,20,21)(H2,14,15,16)