2-[(6-azanyl-2-fluoranyl-purin-9-yl)methoxy]ethyl benzoate

Systemtic Name: 2-[(6-azanyl-2-fluoranyl-purin-9-yl)methoxy]ethyl benzoate Openeye Name: 2-[(6-amino-2-fluoro-purin-9-yl)methoxy]ethyl benzoate CAS Name: benzoic acid 2-[(6-amino-2-fluoro-9-purinyl)methoxy]ethyl ester IUPAC Name: 2-[(6-amino-2-fluoropurin-9-yl)methoxy]ethyl benzoate Traditional Name: benzoic acid 2-[(6-amino-2-fluoro-purin-9-yl)methoxy]ethyl ester Formula: C15H14FN5O3 MolecularWeight: 331.301763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCOCN2C=NC3=C2N=C(N=C3N)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCOCN2C=NC3=C2N=C(N=C3N)F

InChI

InChI=1S/C15H14FN5O3/c16-15-19-12(17)11-13(20-15)21(8-18-11)9-23-6-7-24-14(22)10-4-2-1-3-5-10/h1-5,8H,6-7,9H2,(H2,17,19,20)