pyren-4-yl hydrogen sulfate

Systemtic Name: pyren-4-yl hydrogen sulfate Openeye Name: pyren-4-yl hydrogen sulfate CAS Name: sulfuric acid 4-pyrenyl ester IUPAC Name: pyren-4-yl hydrogen sulfate Traditional Name: sulfuric acid pyren-4-yl ester Formula: C16H10O4S MolecularWeight: 298.3132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=C(C4=CC=CC(=C43)C=C2)OS(=O)(=O)O

Isomeric SMILES

C1=CC2=C3C(=C1)C=C(C4=CC=CC(=C43)C=C2)OS(=O)(=O)O

InChI

InChI=1S/C16H10O4S/c17-21(18,19)20-14-9-12-5-1-3-10-7-8-11-4-2-6-13(14)16(11)15(10)12/h1-9H,(H,17,18,19)