[(2R,3S,5R)-3-acetyloxy-5-[5-(2-bromanyl-1-chloranyl-ethyl)-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3S,5R)-3-acetyloxy-5-[5-(2-bromanyl-1-chloranyl-ethyl)-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-2-yl]methyl ethanoate Openeye Name: [(2R,3S,5R)-3-acetoxy-5-[5-(2-bromo-1-chloro-ethyl)-2,4-dioxo-pyrimidin-1-yl]tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [(2R,3S,5R)-3-acetyloxy-5-[5-(2-bromo-1-chloroethyl)-2,4-dioxo-1-pyrimidinyl]-2-oxolanyl]methyl ester IUPAC Name: [(2R,3S,5R)-3-acetyloxy-5-[5-(2-bromo-1-chloroethyl)-2,4-dioxopyrimidin-1-yl]oxolan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3S,5R)-3-acetoxy-5-[5-(2-bromo-1-chloro-ethyl)-2,4-diketo-pyrimidin-1-yl]tetrahydrofuran-2-yl]methyl ester Formula: C15H18BrClN2O7 MolecularWeight: 453.66962

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1C(CC(O1)N2C=C(C(=O)NC2=O)C(CBr)Cl)OC(=O)C

Isomeric SMILES

CC(=O)OC[C@@H]1[C@H](C[C@@H](O1)N2C=C(C(=O)NC2=O)C(CBr)Cl)OC(=O)C

InChI

InChI=1S/C15H18BrClN2O7/c1-7(20)24-6-12-11(25-8(2)21)3-13(26-12)19-5-9(10(17)4-16)14(22)18-15(19)23/h5,10-13H,3-4,6H2,1-2H3,(H,18,22,23)/t10?,11-,12+,13+/m0/s1