magnesium; 2-hydroxyethyl(trimethyl)azanium; 2-oxidanylbenzoate; sulfate; tetrahydrate

Systemtic Name: magnesium; 2-hydroxyethyl(trimethyl)azanium; 2-oxidanylbenzoate; sulfate; tetrahydrate Openeye Name: magnesium; 2-hydroxybenzoate; 2-hydroxyethyl(trimethyl)ammonium; sulfate; tetrahydrate CAS Name: magnesium; 2-hydroxybenzoate; 2-hydroxyethyl(trimethyl)ammonium; sulfate; tetrahydrate IUPAC Name: magnesium; 2-hydroxybenzoate; 2-hydroxyethyl(trimethyl)azanium; sulfate; tetrahydrate Traditional Name: magnesium; 2-hydroxyethyl(trimethyl)ammonium; salicylate; sulfate; tetrahydrate Formula: C24H46MgN2O16S MolecularWeight: 674.99584

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCO.C[N+](C)(C)CCO.C1=CC=C(C(=C1)C(=O)[O-])O.C1=CC=C(C(=C1)C(=O)[O-])O.O.O.O.O.[O-]S(=O)(=O)[O-].[Mg+2]

Isomeric SMILES

C[N+](C)(C)CCO.C[N+](C)(C)CCO.C1=CC=C(C(=C1)C(=O)[O-])O.C1=CC=C(C(=C1)C(=O)[O-])O.O.O.O.O.[O-]S(=O)(=O)[O-].[Mg+2]

InChI

InChI=1S/2C7H6O3.2C5H14NO.Mg.H2O4S.4H2O/c2*8-6-4-2-1-3-5(6)7(9)10;2*1-6(2,3)4-5-7;;1-5(2,3)4;;;;/h2*1-4,8H,(H,9,10);2*7H,4-5H2,1-3H3;;(H2,1,2,3,4);4*1H2/q;;2*+1;+2;;;;;/p-4