2-[6-azanyl-1-[(3-nitrophenyl)methoxy]-2H-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-azanyl-1-[(3-nitrophenyl)methoxy]-2H-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-amino-1-[(3-nitrophenyl)methoxy]-2H-purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-amino-1-[(3-nitrophenyl)methoxy]-2H-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-amino-1-[(3-nitrophenyl)methoxy]-2H-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-amino-1-(3-nitrobenzyl)oxy-2H-purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C17H20N6O7 MolecularWeight: 420.3767

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1N=C2C(=C(N1OCC3=CC(=CC=C3)[N+](=O)[O-])N)N=CN2C4C(C(C(O4)CO)O)O

Isomeric SMILES

C1N=C2C(=C(N1OCC3=CC(=CC=C3)[N+](=O)[O-])N)N=CN2C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C17H20N6O7/c18-15-12-16(21(7-19-12)17-14(26)13(25)11(5-24)30-17)20-8-22(15)29-6-9-2-1-3-10(4-9)23(27)28/h1-4,7,11,13-14,17,24-26H,5-6,8,18H2