2-azanyl-9-[(2R,4S,5R)-4-oxidanyl-5-(phenoxymethyl)oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(2R,4S,5R)-4-oxidanyl-5-(phenoxymethyl)oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(phenoxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(phenoxymethyl)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(phenoxymethyl)oxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(phenoxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C16H17N5O4 MolecularWeight: 343.33728

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)COC4=CC=CC=C4)O

Isomeric SMILES

C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC(=NC3=O)N)COC4=CC=CC=C4)O

InChI

InChI=1S/C16H17N5O4/c17-16-19-14-13(15(23)20-16)18-8-21(14)12-6-10(22)11(25-12)7-24-9-4-2-1-3-5-9/h1-5,8,10-12,22H,6-7H2,(H3,17,19,20,23)/t10-,11+,12+/m0/s1