2-(4-carboxypyridin-2-yl)pyridine-4-carboxylic acid; 3-methylpentane-2,4-diol; ruthenium

Systemtic Name: 2-(4-carboxypyridin-2-yl)pyridine-4-carboxylic acid; 3-methylpentane-2,4-diol; ruthenium Openeye Name: 2-(4-carboxy-2-pyridyl)pyridine-4-carboxylic acid; 3-methylpentane-2,4-diol; ruthenium CAS Name: 2-(4-carboxy-2-pyridinyl)-4-pyridinecarboxylic acid; 3-methylpentane-2,4-diol; ruthenium IUPAC Name: 2-(4-carboxypyridin-2-yl)pyridine-4-carboxylic acid; 3-methylpentane-2,4-diol; ruthenium Traditional Name: 2-(4-carboxy-2-pyridyl)isonicotinic acid; 3-methylpentane-2,4-diol; ruthenium Formula: C30H30N4O10Ru MolecularWeight: 707.65

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)O)C(C)O.C1=CN=C(C=C1C(=O)O)C2=NC=CC(=C2)C(=O)O.C1=CN=C(C=C1C(=O)O)C2=NC=CC(=C2)C(=O)O.[Ru]

Isomeric SMILES

CC(C(C)O)C(C)O.C1=CN=C(C=C1C(=O)O)C2=NC=CC(=C2)C(=O)O.C1=CN=C(C=C1C(=O)O)C2=NC=CC(=C2)C(=O)O.[Ru]

InChI

InChI=1S/2C12H8N2O4.C6H14O2.Ru/c2*15-11(16)7-1-3-13-9(5-7)10-6-8(12(17)18)2-4-14-10;1-4(5(2)7)6(3)8;/h2*1-6H,(H,15,16)(H,17,18);4-8H,1-3H3;