[4-chloranyl-1-(4,6-dimethoxypyrimidin-2-yl)-3-oxidanylidene-2-benzofuran-1-yl] ethanoate

Systemtic Name: [4-chloranyl-1-(4,6-dimethoxypyrimidin-2-yl)-3-oxidanylidene-2-benzofuran-1-yl] ethanoate Openeye Name: [4-chloro-1-(4,6-dimethoxypyrimidin-2-yl)-3-oxo-isobenzofuran-1-yl] acetate CAS Name: acetic acid [4-chloro-1-(4,6-dimethoxy-2-pyrimidinyl)-3-oxo-1-isobenzofuranyl] ester IUPAC Name: [4-chloro-1-(4,6-dimethoxypyrimidin-2-yl)-3-oxo-2-benzofuran-1-yl] acetate Traditional Name: acetic acid [4-chloro-1-(4,6-dimethoxypyrimidin-2-yl)-3-keto-phthalan-1-yl] ester Formula: C16H13ClN2O6 MolecularWeight: 364.73722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(C2=C(C(=CC=C2)Cl)C(=O)O1)C3=NC(=CC(=N3)OC)OC

Isomeric SMILES

CC(=O)OC1(C2=C(C(=CC=C2)Cl)C(=O)O1)C3=NC(=CC(=N3)OC)OC

InChI

InChI=1S/C16H13ClN2O6/c1-8(20)24-16(15-18-11(22-2)7-12(19-15)23-3)9-5-4-6-10(17)13(9)14(21)25-16/h4-7H,1-3H3