2-(6-azanyl-8-azido-purin-9-yl)-5-(aziridin-1-ylmethyl)oxolane-3,4-diol

Systemtic Name: 2-(6-azanyl-8-azido-purin-9-yl)-5-(aziridin-1-ylmethyl)oxolane-3,4-diol Openeye Name: 2-(6-amino-8-azido-purin-9-yl)-5-(aziridin-1-ylmethyl)tetrahydrofuran-3,4-diol CAS Name: 2-(6-amino-8-azido-9-purinyl)-5-(1-aziridinylmethyl)oxolane-3,4-diol IUPAC Name: 2-(6-amino-8-azidopurin-9-yl)-5-(aziridin-1-ylmethyl)oxolane-3,4-diol Traditional Name: 2-(6-amino-8-azido-purin-9-yl)-5-(ethyleniminomethyl)tetrahydrofuran-3,4-diol Formula: C12H15N9O3 MolecularWeight: 333.306

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Descriptors Computed from Structure

Canonical SMILES:

C1CN1CC2C(C(C(O2)N3C4=C(C(=NC=N4)N)N=C3N=[N+]=[N-])O)O

Isomeric SMILES

C1CN1CC2C(C(C(O2)N3C4=C(C(=NC=N4)N)N=C3N=[N+]=[N-])O)O

InChI

InChI=1S/C12H15N9O3/c13-9-6-10(16-4-15-9)21(12(17-6)18-19-14)11-8(23)7(22)5(24-11)3-20-1-2-20/h4-5,7-8,11,22-23H,1-3H2,(H2,13,15,16)