[(1R,3R)-3-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-1,3-dihydro-2-benzofuran-1-yl]methyl benzoate

Systemtic Name: [(1R,3R)-3-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-1,3-dihydro-2-benzofuran-1-yl]methyl benzoate Openeye Name: [(1R,3R)-3-(2,4-dioxopyrimidin-1-yl)-1,3-dihydroisobenzofuran-1-yl]methyl benzoate CAS Name: benzoic acid [(1R,3R)-3-(2,4-dioxo-1-pyrimidinyl)-1,3-dihydroisobenzofuran-1-yl]methyl ester IUPAC Name: [(1R,3R)-3-(2,4-dioxopyrimidin-1-yl)-1,3-dihydro-2-benzofuran-1-yl]methyl benzoate Traditional Name: benzoic acid [(1R,3R)-3-(2,4-diketopyrimidin-1-yl)phthalan-1-yl]methyl ester Formula: C20H16N2O5 MolecularWeight: 364.35144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCC2C3=CC=CC=C3C(O2)N4C=CC(=O)NC4=O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC[C@H]2C3=CC=CC=C3[C@@H](O2)N4C=CC(=O)NC4=O

InChI

InChI=1S/C20H16N2O5/c23-17-10-11-22(20(25)21-17)18-15-9-5-4-8-14(15)16(27-18)12-26-19(24)13-6-2-1-3-7-13/h1-11,16,18H,12H2,(H,21,23,25)/t16-,18+/m0/s1