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

Systemtic Name: 2-azanyl-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-[(2-nitrophenyl)methoxy]oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-[(2-nitrophenyl)methoxy]tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-[(2-nitrophenyl)methoxy]-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(2R,4S,5R)-5-(hydroxymethyl)-4-[(2-nitrophenyl)methoxy]oxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[(2R,4S,5R)-5-methylol-4-(2-nitrobenzyl)oxy-tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C17H18N6O6 MolecularWeight: 402.36142

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)CO)OCC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1[C@@H]([C@H](O[C@H]1N2C=NC3=C2NC(=NC3=O)N)CO)OCC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C17H18N6O6/c18-17-20-15-14(16(25)21-17)19-8-22(15)13-5-11(12(6-24)29-13)28-7-9-3-1-2-4-10(9)23(26)27/h1-4,8,11-13,24H,5-7H2,(H3,18,20,21,25)/t11-,12+,13+/m0/s1