[5-(6-azanyl-2-fluoranyl-purin-9-yl)-4-fluoranyl-oxolan-2-yl]methyl benzoate

Systemtic Name: [5-(6-azanyl-2-fluoranyl-purin-9-yl)-4-fluoranyl-oxolan-2-yl]methyl benzoate Openeye Name: [5-(6-amino-2-fluoro-purin-9-yl)-4-fluoro-tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [5-(6-amino-2-fluoro-9-purinyl)-4-fluoro-2-oxolanyl]methyl ester IUPAC Name: [5-(6-amino-2-fluoropurin-9-yl)-4-fluorooxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [5-(6-amino-2-fluoro-purin-9-yl)-4-fluoro-tetrahydrofuran-2-yl]methyl ester Formula: C17H15F2N5O3 MolecularWeight: 375.329506

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(C1F)N2C=NC3=C2N=C(N=C3N)F)COC(=O)C4=CC=CC=C4

Isomeric SMILES

C1C(OC(C1F)N2C=NC3=C2N=C(N=C3N)F)COC(=O)C4=CC=CC=C4

InChI

InChI=1S/C17H15F2N5O3/c18-11-6-10(7-26-16(25)9-4-2-1-3-5-9)27-15(11)24-8-21-12-13(20)22-17(19)23-14(12)24/h1-5,8,10-11,15H,6-7H2,(H2,20,22,23)