[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl butanoate

Systemtic Name: [5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl butanoate Openeye Name: [5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl butanoate CAS Name: butanoic acid [5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-2-oxolanyl]methyl ester IUPAC Name: [5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxyoxolan-2-yl]methyl butanoate Traditional Name: butyric acid [5-(2-amino-6-keto-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl ester Formula: C14H19N5O5 MolecularWeight: 337.33116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC1C(CC(O1)N2C=NC3=C2NC(=NC3=O)N)O

Isomeric SMILES

CCCC(=O)OCC1C(CC(O1)N2C=NC3=C2NC(=NC3=O)N)O

InChI

InChI=1S/C14H19N5O5/c1-2-3-10(21)23-5-8-7(20)4-9(24-8)19-6-16-11-12(19)17-14(15)18-13(11)22/h6-9,20H,2-5H2,1H3,(H3,15,17,18,22)