[3-ethanoyl-5-[5-ethanoyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]methyl hypobromite

Systemtic Name: [3-ethanoyl-5-[5-ethanoyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]methyl hypobromite Openeye Name: [3-acetyl-5-(5-acetyl-2,4-dioxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl hypobromite CAS Name: hypobromous acid [3-acetyl-5-(5-acetyl-2,4-dioxo-1-pyrimidinyl)-3-hydroxy-2-oxolanyl]methyl ester IUPAC Name: [3-acetyl-5-(5-acetyl-2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl hypobromite Traditional Name: hypobromous acid [3-acetyl-5-(5-acetyl-2,4-diketo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl ester Formula: C13H15BrN2O7 MolecularWeight: 391.1714

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN(C(=O)NC1=O)C2CC(C(O2)COBr)(C(=O)C)O

Isomeric SMILES

CC(=O)C1=CN(C(=O)NC1=O)C2CC(C(O2)COBr)(C(=O)C)O

InChI

InChI=1S/C13H15BrN2O7/c1-6(17)8-4-16(12(20)15-11(8)19)10-3-13(21,7(2)18)9(23-10)5-22-14/h4,9-10,21H,3,5H2,1-2H3,(H,15,19,20)