3-(6-azanyl-2-hex-1-ynyl-purin-9-yl)propane-1,2-diol

Systemtic Name: 3-(6-azanyl-2-hex-1-ynyl-purin-9-yl)propane-1,2-diol Openeye Name: 3-(6-amino-2-hex-1-ynyl-purin-9-yl)propane-1,2-diol CAS Name: 3-(6-amino-2-hex-1-ynyl-9-purinyl)propane-1,2-diol IUPAC Name: 3-(6-amino-2-hex-1-ynylpurin-9-yl)propane-1,2-diol Traditional Name: 3-(6-amino-2-hex-1-ynyl-purin-9-yl)propane-1,2-diol Formula: C14H19N5O2 MolecularWeight: 289.33296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=NC2=C(C(=N1)N)N=CN2CC(CO)O

Isomeric SMILES

CCCCC#CC1=NC2=C(C(=N1)N)N=CN2CC(CO)O

InChI

InChI=1S/C14H19N5O2/c1-2-3-4-5-6-11-17-13(15)12-14(18-11)19(9-16-12)7-10(21)8-20/h9-10,20-21H,2-4,7-8H2,1H3,(H2,15,17,18)