3-(2-azanylpurin-9-yl)oxypropyl hexanoate

Systemtic Name: 3-(2-azanylpurin-9-yl)oxypropyl hexanoate Openeye Name: 3-(2-aminopurin-9-yl)oxypropyl hexanoate CAS Name: hexanoic acid 3-[(2-amino-9-purinyl)oxy]propyl ester IUPAC Name: 3-(2-aminopurin-9-yl)oxypropyl hexanoate Traditional Name: hexanoic acid 3-(2-aminopurin-9-yl)oxypropyl ester Formula: C14H21N5O3 MolecularWeight: 307.34824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OCCCON1C=NC2=CN=C(N=C21)N

Isomeric SMILES

CCCCCC(=O)OCCCON1C=NC2=CN=C(N=C21)N

InChI

InChI=1S/C14H21N5O3/c1-2-3-4-6-12(20)21-7-5-8-22-19-10-17-11-9-16-14(15)18-13(11)19/h9-10H,2-8H2,1H3,(H2,15,16,18)