9-[3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)oxolan-2-yl]-2-fluoranyl-purin-6-amine

Systemtic Name: 9-[3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)oxolan-2-yl]-2-fluoranyl-purin-6-amine Openeye Name: 9-[3,4-dibenzyloxy-5-(benzyloxymethyl)tetrahydrofuran-2-yl]-2-fluoro-purin-6-amine CAS Name: 9-[3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)-2-oxolanyl]-2-fluoro-6-purinamine IUPAC Name: 9-[3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)oxolan-2-yl]-2-fluoropurin-6-amine Traditional Name: [9-[3,4-dibenzoxy-5-(benzoxymethyl)tetrahydrofuran-2-yl]-2-fluoro-purin-6-yl]amine Formula: C31H30FN5O4 MolecularWeight: 555.599403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2C(C(C(O2)N3C=NC4=C3N=C(N=C4N)F)OCC5=CC=CC=C5)OCC6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)COCC2C(C(C(O2)N3C=NC4=C3N=C(N=C4N)F)OCC5=CC=CC=C5)OCC6=CC=CC=C6

InChI

InChI=1S/C31H30FN5O4/c32-31-35-28(33)25-29(36-31)37(20-34-25)30-27(40-18-23-14-8-3-9-15-23)26(39-17-22-12-6-2-7-13-22)24(41-30)19-38-16-21-10-4-1-5-11-21/h1-15,20,24,26-27,30H,16-19H2,(H2,33,35,36)