diphenanthren-3-yl sulfate

Systemtic Name: diphenanthren-3-yl sulfate Openeye Name: bis(3-phenanthryl) sulfate CAS Name: sulfuric acid bis(3-phenanthrenyl) ester IUPAC Name: diphenanthren-3-yl sulfate Traditional Name: sulfuric acid bis(3-phenanthryl) ester Formula: C28H18O4S MolecularWeight: 450.50512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C=C(C=C3)OS(=O)(=O)OC4=CC5=C(C=CC6=CC=CC=C65)C=C4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C=C(C=C3)OS(=O)(=O)OC4=CC5=C(C=CC6=CC=CC=C65)C=C4

InChI

InChI=1S/C28H18O4S/c29-33(30,31-23-15-13-21-11-9-19-5-1-3-7-25(19)27(21)17-23)32-24-16-14-22-12-10-20-6-2-4-8-26(20)28(22)18-24/h1-18H