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(9-oxidanylidene-1-phenoxy-thioxanthen-4-yl) sulfooxy sulfate

(9-oxidanylidene-1-phenoxy-thioxanthen-4-yl) sulfooxy sulfate

Systemtic Name:(9-oxidanylidene-1-phenoxy-thioxanthen-4-yl) sulfooxy sulfate
Openeye Name:(9-oxo-1-phenoxy-thioxanthen-4-yl) sulfooxy sulfate
CAS Name:sulfuric acid (9-oxo-1-phenoxy-4-thioxanthenyl) sulfooxy ester
IUPAC Name:(9-oxo-1-phenoxythioxanthen-4-yl) sulfooxy sulfate
Traditional Name:sulfuric acid (9-keto-1-phenoxy-thioxanthen-4-yl) sulfoxy ester
Formula: C19H12O10S3
MolecularWeight: 496.48758
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C3C(=C(C=C2)OS(=O)(=O)OOS(=O)(=O)O)SC4=CC=CC=C4C3=O


Isomeric SMILES

C1=CC=C(C=C1)OC2=C3C(=C(C=C2)OS(=O)(=O)OOS(=O)(=O)O)SC4=CC=CC=C4C3=O


InChI

InChI=1S/C19H12O10S3/c20-18-13-8-4-5-9-16(13)30-19-15(27-32(24,25)29-28-31(21,22)23)11-10-14(17(18)19)26-12-6-2-1-3-7-12/h1-11H,(H,21,22,23)


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