2-(6-azanyl-2-oct-1-ynyl-purin-9-yl)oxolane-3,4-diol

Systemtic Name: 2-(6-azanyl-2-oct-1-ynyl-purin-9-yl)oxolane-3,4-diol Openeye Name: 2-(6-amino-2-oct-1-ynyl-purin-9-yl)tetrahydrofuran-3,4-diol CAS Name: 2-(6-amino-2-oct-1-ynyl-9-purinyl)oxolane-3,4-diol IUPAC Name: 2-(6-amino-2-oct-1-ynylpurin-9-yl)oxolane-3,4-diol Traditional Name: 2-(6-amino-2-oct-1-ynyl-purin-9-yl)tetrahydrofuran-3,4-diol Formula: C17H23N5O3 MolecularWeight: 345.39622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=NC2=C(C(=N1)N)N=CN2C3C(C(CO3)O)O

Isomeric SMILES

CCCCCCC#CC1=NC2=C(C(=N1)N)N=CN2C3C(C(CO3)O)O

InChI

InChI=1S/C17H23N5O3/c1-2-3-4-5-6-7-8-12-20-15(18)13-16(21-12)22(10-19-13)17-14(24)11(23)9-25-17/h10-11,14,17,23-24H,2-6,9H2,1H3,(H2,18,20,21)