potassium 9-oxidanylidene-5,7-bis(propan-2-ylsulfanyl)xanthene-2-carboxylate

Systemtic Name: potassium 9-oxidanylidene-5,7-bis(propan-2-ylsulfanyl)xanthene-2-carboxylate Openeye Name: potassium 5,7-bis(isopropylsulfanyl)-9-oxo-xanthene-2-carboxylate CAS Name: potassium 9-oxo-5,7-bis(propan-2-ylthio)-2-xanthenecarboxylate IUPAC Name: potassium 9-oxo-5,7-bis(propan-2-ylsulfanyl)xanthene-2-carboxylate Traditional Name: potassium 5,7-bis(isopropylthio)-9-keto-xanthene-2-carboxylate Formula: C20H19KO4S2 MolecularWeight: 426.59076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC(=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)[O-])SC(C)C.[K+]

Isomeric SMILES

CC(C)SC1=CC(=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)[O-])SC(C)C.[K+]

InChI

InChI=1S/C20H20O4S2.K/c1-10(2)25-13-8-15-18(21)14-7-12(20(22)23)5-6-16(14)24-19(15)17(9-13)26-11(3)4;/h5-11H,1-4H3,(H,22,23);/q;+1/p-1