methyl 6-methylsulfinyl-9-oxidanylidene-xanthene-2-carboxylate

Systemtic Name: methyl 6-methylsulfinyl-9-oxidanylidene-xanthene-2-carboxylate Openeye Name: methyl 6-methylsulfinyl-9-oxo-xanthene-2-carboxylate CAS Name: 6-methylsulfinyl-9-oxo-2-xanthenecarboxylic acid methyl ester IUPAC Name: methyl 6-methylsulfinyl-9-oxoxanthene-2-carboxylate Traditional Name: 9-keto-6-methylsulfinyl-xanthene-2-carboxylic acid methyl ester Formula: C16H12O5S MolecularWeight: 316.32848

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OC3=C(C2=O)C=CC(=C3)S(=O)C

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)OC3=C(C2=O)C=CC(=C3)S(=O)C

InChI

InChI=1S/C16H12O5S/c1-20-16(18)9-3-6-13-12(7-9)15(17)11-5-4-10(22(2)19)8-14(11)21-13/h3-8H,1-2H3