barium(2+); quinoline; sulfate

Systemtic Name: barium(2+); quinoline; sulfate Openeye Name: barium(2+); quinoline; sulfate CAS Name: barium(2+); quinoline; sulfate IUPAC Name: barium(2+); quinoline; sulfate Traditional Name: barium(2+); quinoline; sulfate Formula: C9H7BaNO4S MolecularWeight: 362.54818

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=N2.[O-]S(=O)(=O)[O-].[Ba+2]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=N2.[O-]S(=O)(=O)[O-].[Ba+2]

InChI

InChI=1S/C9H7N.Ba.H2O4S/c1-2-6-9-8(4-1)5-3-7-10-9;;1-5(2,3)4/h1-7H;;(H2,1,2,3,4)/q;+2;/p-2