5-ethyl-9-oxidanylidene-7-propan-2-ylsulfonyl-xanthene-2-carboxylic acid

Systemtic Name: 5-ethyl-9-oxidanylidene-7-propan-2-ylsulfonyl-xanthene-2-carboxylic acid Openeye Name: 5-ethyl-7-isopropylsulfonyl-9-oxo-xanthene-2-carboxylic acid CAS Name: 5-ethyl-9-oxo-7-propan-2-ylsulfonyl-2-xanthenecarboxylic acid IUPAC Name: 5-ethyl-9-oxo-7-propan-2-ylsulfonylxanthene-2-carboxylic acid Traditional Name: 5-ethyl-7-isopropylsulfonyl-9-keto-xanthene-2-carboxylic acid Formula: C19H18O6S MolecularWeight: 374.40762

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC(=C1)S(=O)(=O)C(C)C)C(=O)C3=C(O2)C=CC(=C3)C(=O)O

Isomeric SMILES

CCC1=C2C(=CC(=C1)S(=O)(=O)C(C)C)C(=O)C3=C(O2)C=CC(=C3)C(=O)O

InChI

InChI=1S/C19H18O6S/c1-4-11-7-13(26(23,24)10(2)3)9-15-17(20)14-8-12(19(21)22)5-6-16(14)25-18(11)15/h5-10H,4H2,1-3H3,(H,21,22)