butan-2-yl 6-methylsulfinyl-9-oxidanylidene-xanthene-2-carboxylate

Systemtic Name: butan-2-yl 6-methylsulfinyl-9-oxidanylidene-xanthene-2-carboxylate Openeye Name: sec-butyl 6-methylsulfinyl-9-oxo-xanthene-2-carboxylate CAS Name: 6-methylsulfinyl-9-oxo-2-xanthenecarboxylic acid butan-2-yl ester IUPAC Name: butan-2-yl 6-methylsulfinyl-9-oxoxanthene-2-carboxylate Traditional Name: 9-keto-6-methylsulfinyl-xanthene-2-carboxylic acid sec-butyl ester Formula: C19H18O5S MolecularWeight: 358.40822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18O5S/c1-4-11(2)23-19(21)12-5-8-16-15(9-12)18(20)14-7-6-13(25(3)22)10-17(14)24-16/h5-11H,4H2,1-3H3