magnesium 2-phenylethanesulfonate

Systemtic Name: magnesium 2-phenylethanesulfonate Openeye Name: magnesium 2-phenylethanesulfonate CAS Name: magnesium 2-phenylethanesulfonate IUPAC Name: magnesium 2-phenylethanesulfonate Traditional Name: magnesium 2-phenylethanesulfonate Formula: C16H18MgO6S2 MolecularWeight: 394.74552

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCS(=O)(=O)[O-].C1=CC=C(C=C1)CCS(=O)(=O)[O-].[Mg+2]

Isomeric SMILES

C1=CC=C(C=C1)CCS(=O)(=O)[O-].C1=CC=C(C=C1)CCS(=O)(=O)[O-].[Mg+2]

InChI

InChI=1S/2C8H10O3S.Mg/c2*9-12(10,11)7-6-8-4-2-1-3-5-8;/h2*1-5H,6-7H2,(H,9,10,11);/q;;+2/p-2