5-ethylsulfonyl-9-oxidanylidene-7-propan-2-yloxy-xanthene-2-carboxylic acid

Systemtic Name: 5-ethylsulfonyl-9-oxidanylidene-7-propan-2-yloxy-xanthene-2-carboxylic acid Openeye Name: 5-ethylsulfonyl-7-isopropoxy-9-oxo-xanthene-2-carboxylic acid CAS Name: 5-ethylsulfonyl-9-oxo-7-propan-2-yloxy-2-xanthenecarboxylic acid IUPAC Name: 5-ethylsulfonyl-9-oxo-7-propan-2-yloxyxanthene-2-carboxylic acid Traditional Name: 5-esyl-7-isopropoxy-9-keto-xanthene-2-carboxylic acid Formula: C19H18O7S MolecularWeight: 390.40702

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C2C(=CC(=C1)OC(C)C)C(=O)C3=C(O2)C=CC(=C3)C(=O)O

Isomeric SMILES

CCS(=O)(=O)C1=C2C(=CC(=C1)OC(C)C)C(=O)C3=C(O2)C=CC(=C3)C(=O)O

InChI

InChI=1S/C19H18O7S/c1-4-27(23,24)16-9-12(25-10(2)3)8-14-17(20)13-7-11(19(21)22)5-6-15(13)26-18(14)16/h5-10H,4H2,1-3H3,(H,21,22)