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

Systemtic Name: [2-[(2-azanyl-6-fluoranyl-purin-9-yl)methoxy]-3-oxidanyl-propyl] 2-methylpropanoate Openeye Name: [2-[(2-amino-6-fluoro-purin-9-yl)methoxy]-3-hydroxy-propyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [2-[(2-amino-6-fluoro-9-purinyl)methoxy]-3-hydroxypropyl] ester IUPAC Name: [2-[(2-amino-6-fluoropurin-9-yl)methoxy]-3-hydroxypropyl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [2-[(2-amino-6-fluoro-purin-9-yl)methoxy]-3-hydroxy-propyl] ester Formula: C13H18FN5O4 MolecularWeight: 327.311523

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18FN5O4/c1-7(2)12(21)22-4-8(3-20)23-6-19-5-16-9-10(14)17-13(15)18-11(9)19/h5,7-8,20H,3-4,6H2,1-2H3,(H2,15,17,18)