butyl 2-[2-(hydroxymethyl)-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]hexanoate

Systemtic Name: butyl 2-[2-(hydroxymethyl)-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]hexanoate Openeye Name: butyl 2-[2-(hydroxymethyl)-6-methyl-4-oxo-1H-pyrimidin-5-yl]hexanoate CAS Name: 2-[2-(hydroxymethyl)-6-methyl-4-oxo-1H-pyrimidin-5-yl]hexanoic acid butyl ester IUPAC Name: butyl 2-[2-(hydroxymethyl)-6-methyl-4-oxo-1H-pyrimidin-5-yl]hexanoate Traditional Name: 2-(4-keto-6-methyl-2-methylol-1H-pyrimidin-5-yl)hexanoic acid butyl ester Formula: C16H26N2O4 MolecularWeight: 310.38864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=C(NC(=NC1=O)CO)C)C(=O)OCCCC

Isomeric SMILES

CCCCC(C1=C(NC(=NC1=O)CO)C)C(=O)OCCCC

InChI

InChI=1S/C16H26N2O4/c1-4-6-8-12(16(21)22-9-7-5-2)14-11(3)17-13(10-19)18-15(14)20/h12,19H,4-10H2,1-3H3,(H,17,18,20)