[(1S)-1,7-dimethyl-3-oxidanylidene-1,2-dihydroinden-4-yl] 1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidine-5-sulfonate

Systemtic Name: [(1S)-1,7-dimethyl-3-oxidanylidene-1,2-dihydroinden-4-yl] 1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidine-5-sulfonate Openeye Name: [(1S)-1,7-dimethyl-3-oxo-indan-4-yl] 1,3-dimethyl-2,4-dioxo-pyrimidine-5-sulfonate CAS Name: 1,3-dimethyl-2,4-dioxo-5-pyrimidinesulfonic acid [(1S)-1,7-dimethyl-3-oxo-1,2-dihydroinden-4-yl] ester IUPAC Name: [(1S)-1,7-dimethyl-3-oxo-1,2-dihydroinden-4-yl] 1,3-dimethyl-2,4-dioxopyrimidine-5-sulfonate Traditional Name: 2,4-diketo-1,3-dimethyl-pyrimidine-5-sulfonic acid [(1S)-3-keto-1,7-dimethyl-indan-4-yl] ester Formula: C17H18N2O6S MolecularWeight: 378.39962

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C2=C(C=CC(=C12)C)OS(=O)(=O)C3=CN(C(=O)N(C3=O)C)C

Isomeric SMILES

C[C@H]1CC(=O)C2=C(C=CC(=C12)C)OS(=O)(=O)C3=CN(C(=O)N(C3=O)C)C

InChI

InChI=1S/C17H18N2O6S/c1-9-5-6-12(15-11(20)7-10(2)14(9)15)25-26(23,24)13-8-18(3)17(22)19(4)16(13)21/h5-6,8,10H,7H2,1-4H3/t10-/m0/s1