[5-[5-ethyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-(3-oxidanyl-4-phenyl-butyl)oxolan-3-yl] ethanoate

Systemtic Name: [5-[5-ethyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-(3-oxidanyl-4-phenyl-butyl)oxolan-3-yl] ethanoate Openeye Name: [5-(5-ethyl-2,4-dioxo-pyrimidin-1-yl)-2-(3-hydroxy-4-phenyl-butyl)tetrahydrofuran-3-yl] acetate CAS Name: acetic acid [5-(5-ethyl-2,4-dioxo-1-pyrimidinyl)-2-(3-hydroxy-4-phenylbutyl)-3-oxolanyl] ester IUPAC Name: [5-(5-ethyl-2,4-dioxopyrimidin-1-yl)-2-(3-hydroxy-4-phenylbutyl)oxolan-3-yl] acetate Traditional Name: acetic acid [5-(5-ethyl-2,4-diketo-pyrimidin-1-yl)-2-(3-hydroxy-4-phenyl-butyl)tetrahydrofuran-3-yl] ester Formula: C22H28N2O6 MolecularWeight: 416.46752

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C(=O)NC1=O)C2CC(C(O2)CCC(CC3=CC=CC=C3)O)OC(=O)C

Isomeric SMILES

CCC1=CN(C(=O)NC1=O)C2CC(C(O2)CCC(CC3=CC=CC=C3)O)OC(=O)C

InChI

InChI=1S/C22H28N2O6/c1-3-16-13-24(22(28)23-21(16)27)20-12-19(29-14(2)25)18(30-20)10-9-17(26)11-15-7-5-4-6-8-15/h4-8,13,17-20,26H,3,9-12H2,1-2H3,(H,23,27,28)