disodium bis[(7-methanoyl-5-sulfonato-quinolin-8-yl)oxy]antimony hydrate

Systemtic Name: disodium bis[(7-methanoyl-5-sulfonato-quinolin-8-yl)oxy]antimony hydrate Openeye Name: disodium bis[(7-formyl-5-sulfonato-8-quinolyl)oxy]antimony hydrate CAS Name: disodium bis[(7-formyl-5-sulfonato-8-quinolinyl)oxy]antimony hydrate IUPAC Name: disodium bis[(7-formyl-5-sulfonatoquinolin-8-yl)oxy]antimony hydrate Traditional Name: disodium bis[(7-formyl-5-sulfonato-8-quinolyl)oxy]antimony hydrate Formula: C20H12N2Na2O11S2Sb MolecularWeight: 688.18562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C(C(=C2N=C1)O[Sb]OC3=C4C(=C(C=C3C=O)S(=O)(=O)[O-])C=CC=N4)C=O)S(=O)(=O)[O-].O.[Na+].[Na+]

Isomeric SMILES

C1=CC2=C(C=C(C(=C2N=C1)O[Sb]OC3=C4C(=C(C=C3C=O)S(=O)(=O)[O-])C=CC=N4)C=O)S(=O)(=O)[O-].O.[Na+].[Na+]

InChI

InChI=1S/2C10H7NO5S.2Na.H2O.Sb/c2*12-5-6-4-8(17(14,15)16)7-2-1-3-11-9(7)10(6)13;;;;/h2*1-5,13H,(H,14,15,16);;;1H2;/q;;2*+1;;+2/p-4