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

Systemtic Name: 7-ethylsulfonyl-9-oxidanylidene-5-propan-2-yloxy-xanthene-2-carboxylic acid Openeye Name: 7-ethylsulfonyl-5-isopropoxy-9-oxo-xanthene-2-carboxylic acid CAS Name: 7-ethylsulfonyl-9-oxo-5-propan-2-yloxy-2-xanthenecarboxylic acid IUPAC Name: 7-ethylsulfonyl-9-oxo-5-propan-2-yloxyxanthene-2-carboxylic acid Traditional Name: 7-esyl-5-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=CC(=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O)OC(C)C

Isomeric SMILES

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

InChI

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