[2-[(2-azanyl-6-fluoranyl-purin-9-yl)methoxy]-3-oxidanyl-propyl] propanoate

Systemtic Name: [2-[(2-azanyl-6-fluoranyl-purin-9-yl)methoxy]-3-oxidanyl-propyl] propanoate Openeye Name: [2-[(2-amino-6-fluoro-purin-9-yl)methoxy]-3-hydroxy-propyl] propanoate CAS Name: propanoic acid [2-[(2-amino-6-fluoro-9-purinyl)methoxy]-3-hydroxypropyl] ester IUPAC Name: [2-[(2-amino-6-fluoropurin-9-yl)methoxy]-3-hydroxypropyl] propanoate Traditional Name: propionic acid [2-[(2-amino-6-fluoro-purin-9-yl)methoxy]-3-hydroxy-propyl] ester Formula: C12H16FN5O4 MolecularWeight: 313.284943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCC(CO)OCN1C=NC2=C1N=C(N=C2F)N

Isomeric SMILES

CCC(=O)OCC(CO)OCN1C=NC2=C1N=C(N=C2F)N

InChI

InChI=1S/C12H16FN5O4/c1-2-8(20)21-4-7(3-19)22-6-18-5-15-9-10(13)16-12(14)17-11(9)18/h5,7,19H,2-4,6H2,1H3,(H2,14,16,17)