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

Systemtic Name: [5-(6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]methyl 2-methylpentanoate Openeye Name: [5-(6-oxo-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl 2-methylpentanoate CAS Name: 2-methylpentanoic acid [5-(6-oxo-3H-purin-9-yl)-2-oxolanyl]methyl ester IUPAC Name: [5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]methyl 2-methylpentanoate Traditional Name: 2-methylvaleric acid [5-(6-keto-3H-purin-9-yl)tetrahydrofuran-2-yl]methyl ester Formula: C16H22N4O4 MolecularWeight: 334.37028

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(=O)OCC1CCC(O1)N2C=NC3=C2NC=NC3=O

Isomeric SMILES

CCCC(C)C(=O)OCC1CCC(O1)N2C=NC3=C2NC=NC3=O

InChI

InChI=1S/C16H22N4O4/c1-3-4-10(2)16(22)23-7-11-5-6-12(24-11)20-9-19-13-14(20)17-8-18-15(13)21/h8-12H,3-7H2,1-2H3,(H,17,18,21)