[(2R,3R,4S,5R)-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-4-bromanyl-3-(phenylcarbonyloxy)-5-prop-2-enyl-oxolan-2-yl]methyl benzoate

Systemtic Name: [(2R,3R,4S,5R)-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-4-bromanyl-3-(phenylcarbonyloxy)-5-prop-2-enyl-oxolan-2-yl]methyl benzoate Openeye Name: [(2R,3R,4S,5R)-5-allyl-3-benzoyloxy-4-bromo-5-(2,4-dioxopyrimidin-1-yl)tetrahydrofuran-2-yl]methyl benzoate CAS Name: benzoic acid [(2R,3R,4S,5R)-3-benzoyloxy-4-bromo-5-(2,4-dioxo-1-pyrimidinyl)-5-prop-2-enyl-2-oxolanyl]methyl ester IUPAC Name: [(2R,3R,4S,5R)-3-benzoyloxy-4-bromo-5-(2,4-dioxopyrimidin-1-yl)-5-prop-2-enyloxolan-2-yl]methyl benzoate Traditional Name: benzoic acid [(2R,3R,4S,5R)-5-allyl-3-benzoyloxy-4-bromo-5-(2,4-diketopyrimidin-1-yl)tetrahydrofuran-2-yl]methyl ester Formula: C26H23BrN2O7 MolecularWeight: 555.37402

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1(C(C(C(O1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)Br)N4C=CC(=O)NC4=O

Isomeric SMILES

C=CC[C@@]1([C@H]([C@@H]([C@H](O1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)Br)N4C=CC(=O)NC4=O

InChI

InChI=1S/C26H23BrN2O7/c1-2-14-26(29-15-13-20(30)28-25(29)33)22(27)21(35-24(32)18-11-7-4-8-12-18)19(36-26)16-34-23(31)17-9-5-3-6-10-17/h2-13,15,19,21-22H,1,14,16H2,(H,28,30,33)/t19-,21-,22+,26-/m1/s1