dioxidanium; 5-[bis(oxidanyl)methyl]-2H-pyridin-1-ide-2-carboxylic acid; cobalt; dihydrate

Systemtic Name: dioxidanium; 5-[bis(oxidanyl)methyl]-2H-pyridin-1-ide-2-carboxylic acid; cobalt; dihydrate Openeye Name: dioxonium; cobalt; 5-(dihydroxymethyl)-2H-pyridin-1-ide-2-carboxylic acid; dihydrate CAS Name: dioxonium; cobalt; 5-(dihydroxymethyl)-2H-pyridin-1-ide-2-carboxylic acid; dihydrate IUPAC Name: dioxidanium; cobalt; 5-(dihydroxymethyl)-2H-pyridin-1-ide-2-carboxylic acid; dihydrate Traditional Name: dioxonium; cobalt; 5-(dihydroxymethyl)-2H-pyridin-1-ide-2-carboxylic acid; dihydrate Formula: C7H18Co3NO8+ MolecularWeight: 421.01932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N-]C1C(=O)O)C(O)O.[OH3+].[OH3+].O.O.[Co].[Co].[Co]

Isomeric SMILES

C1=CC(=C[N-]C1C(=O)O)C(O)O.[OH3+].[OH3+].O.O.[Co].[Co].[Co]

InChI

InChI=1S/C7H8NO4.3Co.4H2O/c9-6(10)4-1-2-5(7(11)12)8-3-4;;;;;;;/h1-3,5-6,9-10H,(H,11,12);;;;4*1H2/q-1;;;;;;;/p+2