7-ethylsulfinyl-9-oxidanylidene-5-propyl-xanthene-2-carboxylic acid

Systemtic Name: 7-ethylsulfinyl-9-oxidanylidene-5-propyl-xanthene-2-carboxylic acid Openeye Name: 7-ethylsulfinyl-9-oxo-5-propyl-xanthene-2-carboxylic acid CAS Name: 7-ethylsulfinyl-9-oxo-5-propyl-2-xanthenecarboxylic acid IUPAC Name: 7-ethylsulfinyl-9-oxo-5-propylxanthene-2-carboxylic acid Traditional Name: 7-ethylsulfinyl-9-keto-5-propyl-xanthene-2-carboxylic acid Formula: C19H18O5S MolecularWeight: 358.40822

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=CC(=C1)S(=O)CC)C(=O)C3=C(O2)C=CC(=C3)C(=O)O

Isomeric SMILES

CCCC1=C2C(=CC(=C1)S(=O)CC)C(=O)C3=C(O2)C=CC(=C3)C(=O)O

InChI

InChI=1S/C19H18O5S/c1-3-5-11-8-13(25(23)4-2)10-15-17(20)14-9-12(19(21)22)6-7-16(14)24-18(11)15/h6-10H,3-5H2,1-2H3,(H,21,22)