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

Systemtic Name: 5-ethyl-7-ethylsulfinyl-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 5-ethyl-7-ethylsulfinyl-9-oxo-xanthene-2-carboxylic acid CAS Name: 5-ethyl-7-ethylsulfinyl-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 5-ethyl-7-ethylsulfinyl-9-oxoxanthene-2-carboxylic acid Traditional Name: 5-ethyl-7-ethylsulfinyl-9-keto-xanthene-2-carboxylic acid Formula: C18H16O5S MolecularWeight: 344.38164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16O5S/c1-3-10-7-12(24(22)4-2)9-14-16(19)13-8-11(18(20)21)5-6-15(13)23-17(10)14/h5-9H,3-4H2,1-2H3,(H,20,21)