trimagnesium; 2-oxidanylpropanoate; pyridine-3-carboxylate; dimethanoate

Systemtic Name: trimagnesium; 2-oxidanylpropanoate; pyridine-3-carboxylate; dimethanoate Openeye Name: trimagnesium; 2-hydroxypropanoate; pyridine-3-carboxylate; diformate CAS Name: trimagnesium; 2-hydroxypropanoate; 3-pyridinecarboxylate; diformate IUPAC Name: trimagnesium; 2-hydroxypropanoate; pyridine-3-carboxylate; diformate Traditional Name: trimagnesium; lactate; nicotinate; diformate Formula: C20H20Mg3N2O14 MolecularWeight: 585.2928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C6H5NO2.2C3H6O3.2CH2O2.3Mg/c2*8-6(9)5-2-1-3-7-4-5;2*1-2(4)3(5)6;2*2-1-3;;;/h2*1-4H,(H,8,9);2*2,4H,1H3,(H,5,6);2*1H,(H,2,3);;;/q;;;;;;3*+2/p-6