2-[6-[(2-azidophenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name: 2-[6-[(2-azidophenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Openeye Name: 2-[6-[(2-azidophenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol CAS Name: 2-[6-[(2-azidophenyl)methylamino]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol IUPAC Name: 2-[6-[(2-azidophenyl)methylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol Traditional Name: 2-[6-[(2-azidobenzyl)amino]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol Formula: C17H18N8O4 MolecularWeight: 398.37602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)N=[N+]=[N-]

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=NC=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)N=[N+]=[N-]

InChI

InChI=1S/C17H18N8O4/c18-24-23-10-4-2-1-3-9(10)5-19-15-12-16(21-7-20-15)25(8-22-12)17-14(28)13(27)11(6-26)29-17/h1-4,7-8,11,13-14,17,26-28H,5-6H2,(H,19,20,21)