propan-2-yl 9-oxidanylidenethioxanthene-4-sulfonate

Systemtic Name: propan-2-yl 9-oxidanylidenethioxanthene-4-sulfonate Openeye Name: isopropyl 9-oxothioxanthene-4-sulfonate CAS Name: 9-oxo-4-thioxanthenesulfonic acid propan-2-yl ester IUPAC Name: propan-2-yl 9-oxothioxanthene-4-sulfonate Traditional Name: 9-ketothioxanthene-4-sulfonic acid isopropyl ester Formula: C16H14O4S2 MolecularWeight: 334.40996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OS(=O)(=O)C1=CC=CC2=C1SC3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)OS(=O)(=O)C1=CC=CC2=C1SC3=CC=CC=C3C2=O

InChI

InChI=1S/C16H14O4S2/c1-10(2)20-22(18,19)14-9-5-7-12-15(17)11-6-3-4-8-13(11)21-16(12)14/h3-10H,1-2H3