5-iodanyl-2-(3-oxidanyl-6-oxidanylidene-xanthen-9-yl)benzenesulfonic acid

Systemtic Name: 5-iodanyl-2-(3-oxidanyl-6-oxidanylidene-xanthen-9-yl)benzenesulfonic acid Openeye Name: 2-(3-hydroxy-6-oxo-xanthen-9-yl)-5-iodo-benzenesulfonic acid CAS Name: 2-(3-hydroxy-6-oxo-9-xanthenyl)-5-iodobenzenesulfonic acid IUPAC Name: 2-(3-hydroxy-6-oxoxanthen-9-yl)-5-iodobenzenesulfonic acid Traditional Name: 2-(3-hydroxy-6-keto-xanthen-9-yl)-5-iodo-besylic acid Formula: C19H11IO6S MolecularWeight: 494.25651

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)OC3=CC(=O)C=CC3=C2C4=C(C=C(C=C4)I)S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C=C1O)OC3=CC(=O)C=CC3=C2C4=C(C=C(C=C4)I)S(=O)(=O)O

InChI

InChI=1S/C19H11IO6S/c20-10-1-4-15(18(7-10)27(23,24)25)19-13-5-2-11(21)8-16(13)26-17-9-12(22)3-6-14(17)19/h1-9,21H,(H,23,24,25)