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

Systemtic Name: [2-[(2-azanyl-6-fluoranyl-purin-9-yl)methoxy]-3-oxidanyl-propyl] butanoate Openeye Name: [2-[(2-amino-6-fluoro-purin-9-yl)methoxy]-3-hydroxy-propyl] butanoate CAS Name: butanoic acid [2-[(2-amino-6-fluoro-9-purinyl)methoxy]-3-hydroxypropyl] ester IUPAC Name: [2-[(2-amino-6-fluoropurin-9-yl)methoxy]-3-hydroxypropyl] butanoate Traditional Name: butyric 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:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18FN5O4/c1-2-3-9(21)22-5-8(4-20)23-7-19-6-16-10-11(14)17-13(15)18-12(10)19/h6,8,20H,2-5,7H2,1H3,(H2,15,17,18)