ethyl 5-methylsulfonyl-9-oxidanylidene-7-propan-2-yloxy-xanthene-2-carboxylate

Systemtic Name: ethyl 5-methylsulfonyl-9-oxidanylidene-7-propan-2-yloxy-xanthene-2-carboxylate Openeye Name: ethyl 7-isopropoxy-5-methylsulfonyl-9-oxo-xanthene-2-carboxylate CAS Name: 5-methylsulfonyl-9-oxo-7-propan-2-yloxy-2-xanthenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methylsulfonyl-9-oxo-7-propan-2-yloxyxanthene-2-carboxylate Traditional Name: 7-isopropoxy-9-keto-5-mesyl-xanthene-2-carboxylic acid ethyl ester Formula: C20H20O7S MolecularWeight: 404.4336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)OC3=C(C=C(C=C3C2=O)OC(C)C)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)OC3=C(C=C(C=C3C2=O)OC(C)C)S(=O)(=O)C

InChI

InChI=1S/C20H20O7S/c1-5-25-20(22)12-6-7-16-14(8-12)18(21)15-9-13(26-11(2)3)10-17(19(15)27-16)28(4,23)24/h6-11H,5H2,1-4H3