[(1R,5R,7R,8S)-7-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-8-phenylmethoxy-3,6-dioxabicyclo[3.2.1]octan-5-yl]methyl ethanoate

Systemtic Name: [(1R,5R,7R,8S)-7-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-8-phenylmethoxy-3,6-dioxabicyclo[3.2.1]octan-5-yl]methyl ethanoate Openeye Name: [(1R,5R,7R,8S)-8-benzyloxy-7-(2,4-dioxopyrimidin-1-yl)-3,6-dioxabicyclo[3.2.1]octan-5-yl]methyl acetate CAS Name: acetic acid [(1R,5R,7R,8S)-7-(2,4-dioxo-1-pyrimidinyl)-8-phenylmethoxy-3,6-dioxabicyclo[3.2.1]octan-5-yl]methyl ester IUPAC Name: [(1R,5R,7R,8S)-7-(2,4-dioxopyrimidin-1-yl)-8-phenylmethoxy-3,6-dioxabicyclo[3.2.1]octan-5-yl]methyl acetate Traditional Name: acetic acid [(1R,5R,7R,8S)-8-benzoxy-7-(2,4-diketopyrimidin-1-yl)-3,6-dioxabicyclo[3.2.1]octan-5-yl]methyl ester Formula: C20H22N2O7 MolecularWeight: 402.39788

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC12COCC(C1OCC3=CC=CC=C3)C(O2)N4C=CC(=O)NC4=O

Isomeric SMILES

CC(=O)OC[C@]12COC[C@H]([C@@H]1OCC3=CC=CC=C3)[C@@H](O2)N4C=CC(=O)NC4=O

InChI

InChI=1S/C20H22N2O7/c1-13(23)28-12-20-11-26-10-15(17(20)27-9-14-5-3-2-4-6-14)18(29-20)22-8-7-16(24)21-19(22)25/h2-8,15,17-18H,9-12H2,1H3,(H,21,24,25)/t15-,17+,18-,20-/m1/s1