(3,4,5,6,7-pentaacetyloxy-9-oxidanylidene-thioxanthen-2-yl) ethanoate

Systemtic Name: (3,4,5,6,7-pentaacetyloxy-9-oxidanylidene-thioxanthen-2-yl) ethanoate Openeye Name: (3,4,5,6,7-pentaacetoxy-9-oxo-thioxanthen-2-yl) acetate CAS Name: acetic acid (3,4,5,6,7-pentaacetyloxy-9-oxo-2-thioxanthenyl) ester IUPAC Name: (3,4,5,6,7-pentaacetyloxy-9-oxothioxanthen-2-yl) acetate Traditional Name: acetic acid (3,4,5,6,7-pentaacetoxy-9-keto-thioxanthen-2-yl) ester Formula: C25H20O13S MolecularWeight: 560.4835

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=C2C(=C1)C(=O)C3=CC(=C(C(=C3S2)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C(=C2C(=C1)C(=O)C3=CC(=C(C(=C3S2)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C25H20O13S/c1-9(26)33-17-7-15-19(32)16-8-18(34-10(2)27)21(36-12(4)29)23(38-14(6)31)25(16)39-24(15)22(37-13(5)30)20(17)35-11(3)28/h7-8H,1-6H3