(2,2-dimethyl-3H-1-benzofuran-7-yl) 1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidine-5-sulfonate

Systemtic Name: (2,2-dimethyl-3H-1-benzofuran-7-yl) 1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidine-5-sulfonate Openeye Name: (2,2-dimethyl-3H-benzofuran-7-yl) 1,3-dimethyl-2,4-dioxo-pyrimidine-5-sulfonate CAS Name: 1,3-dimethyl-2,4-dioxo-5-pyrimidinesulfonic acid (2,2-dimethyl-3H-benzofuran-7-yl) ester IUPAC Name: (2,2-dimethyl-3H-1-benzofuran-7-yl) 1,3-dimethyl-2,4-dioxopyrimidine-5-sulfonate Traditional Name: 2,4-diketo-1,3-dimethyl-pyrimidine-5-sulfonic acid (2,2-dimethylcoumaran-7-yl) ester Formula: C16H18N2O6S MolecularWeight: 366.38892

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)OS(=O)(=O)C3=CN(C(=O)N(C3=O)C)C)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)OS(=O)(=O)C3=CN(C(=O)N(C3=O)C)C)C

InChI

InChI=1S/C16H18N2O6S/c1-16(2)8-10-6-5-7-11(13(10)23-16)24-25(21,22)12-9-17(3)15(20)18(4)14(12)19/h5-7,9H,8H2,1-4H3