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

Systemtic Name: 2-azanyl-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-(methylideneamino)oxy-oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-(methyleneamino)oxy-tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-(methyleneamino)oxy-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-(methylideneamino)oxyoxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[(2R,4S,5R)-4-(methyleneamino)oxy-5-methylol-tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C11H14N6O4 MolecularWeight: 294.26666

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Descriptors Computed from Structure

Canonical SMILES:

C=NOC1CC(OC1CO)N2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

C=NO[C@H]1C[C@@H](O[C@@H]1CO)N2C=NC3=C2NC(=NC3=O)N

InChI

InChI=1S/C11H14N6O4/c1-13-21-5-2-7(20-6(5)3-18)17-4-14-8-9(17)15-11(12)16-10(8)19/h4-7,18H,1-3H2,(H3,12,15,16,19)/t5-,6+,7+/m0/s1