pyrene sulfate

Systemtic Name: pyrene sulfate Openeye Name: pyrene sulfate CAS Name: pyrene sulfate IUPAC Name: pyrene sulfate Traditional Name: pyrene sulfate Formula: C16H10O4S-2 MolecularWeight: 298.3132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=CC4=CC=CC(=C43)C=C2.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1=CC2=C3C(=C1)C=CC4=CC=CC(=C43)C=C2.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C16H10.H2O4S/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14;1-5(2,3)4/h1-10H;(H2,1,2,3,4)/p-2