[3-(2-butoxy-1-oxidanyl-2-oxidanylidene-ethyl)-2-oxidanylidene-4H-pyrimidin-1-yl] 2-oxidanylhexanoate

Systemtic Name: [3-(2-butoxy-1-oxidanyl-2-oxidanylidene-ethyl)-2-oxidanylidene-4H-pyrimidin-1-yl] 2-oxidanylhexanoate Openeye Name: [3-(2-butoxy-1-hydroxy-2-oxo-ethyl)-2-oxo-4H-pyrimidin-1-yl] 2-hydroxyhexanoate CAS Name: 2-hydroxyhexanoic acid [3-(2-butoxy-1-hydroxy-2-oxoethyl)-2-oxo-4H-pyrimidin-1-yl] ester IUPAC Name: [3-(2-butoxy-1-hydroxy-2-oxoethyl)-2-oxo-4H-pyrimidin-1-yl] 2-hydroxyhexanoate Traditional Name: 2-hydroxyhexanoic acid [3-(2-butoxy-1-hydroxy-2-keto-ethyl)-2-keto-4H-pyrimidin-1-yl] ester Formula: C16H26N2O7 MolecularWeight: 358.38684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)ON1C=CCN(C1=O)C(C(=O)OCCCC)O)O

Isomeric SMILES

CCCCC(C(=O)ON1C=CCN(C1=O)C(C(=O)OCCCC)O)O

InChI

InChI=1S/C16H26N2O7/c1-3-5-8-12(19)14(21)25-18-10-7-9-17(16(18)23)13(20)15(22)24-11-6-4-2/h7,10,12-13,19-20H,3-6,8-9,11H2,1-2H3