2-ethenyl-9-[(2R,3R,5S)-5-(hydroxymethyl)-3-oxidanyl-oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-ethenyl-9-[(2R,3R,5S)-5-(hydroxymethyl)-3-oxidanyl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 9-[(2R,3R,5S)-3-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-vinyl-3H-purin-6-one CAS Name: 2-ethenyl-9-[(2R,3R,5S)-3-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-ethenyl-9-[(2R,3R,5S)-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one Traditional Name: 9-[(2R,3R,5S)-3-hydroxy-5-methylol-tetrahydrofuran-2-yl]-2-vinyl-3H-purin-6-one Formula: C12H14N4O4 MolecularWeight: 278.26396

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=NC(=O)C2=C(N1)N(C=N2)C3C(CC(O3)CO)O

Isomeric SMILES

C=CC1=NC(=O)C2=C(N1)N(C=N2)[C@H]3[C@@H](C[C@H](O3)CO)O

InChI

InChI=1S/C12H14N4O4/c1-2-8-14-10-9(11(19)15-8)13-5-16(10)12-7(18)3-6(4-17)20-12/h2,5-7,12,17-18H,1,3-4H2,(H,14,15,19)/t6-,7+,12+/m0/s1