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9-oxidanylidene-1-propyl-6-propylsulfinyl-xanthene-2-carboxylic acid

9-oxidanylidene-1-propyl-6-propylsulfinyl-xanthene-2-carboxylic acid

Systemtic Name:9-oxidanylidene-1-propyl-6-propylsulfinyl-xanthene-2-carboxylic acid
Openeye Name:9-oxo-1-propyl-6-propylsulfinyl-xanthene-2-carboxylic acid
CAS Name:9-oxo-1-propyl-6-propylsulfinyl-2-xanthenecarboxylic acid
IUPAC Name:9-oxo-1-propyl-6-propylsulfinylxanthene-2-carboxylic acid
Traditional Name:9-keto-1-propyl-6-propylsulfinyl-xanthene-2-carboxylic acid
Formula: C20H20O5S
MolecularWeight: 372.4348
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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1C(=O)C3=C(O2)C=C(C=C3)S(=O)CCC)C(=O)O


Isomeric SMILES

CCCC1=C(C=CC2=C1C(=O)C3=C(O2)C=C(C=C3)S(=O)CCC)C(=O)O


InChI

InChI=1S/C20H20O5S/c1-3-5-13-14(20(22)23)8-9-16-18(13)19(21)15-7-6-12(11-17(15)25-16)26(24)10-4-2/h6-9,11H,3-5,10H2,1-2H3,(H,22,23)


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