cobalt; 2-(7-oxidanylidene-9-thia-6-azaspiro[4.4]nonan-6-yl)benzoic acid

Systemtic Name: cobalt; 2-(7-oxidanylidene-9-thia-6-azaspiro[4.4]nonan-6-yl)benzoic acid Openeye Name: cobalt; 2-(7-oxo-9-thia-6-azaspiro[4.4]nonan-6-yl)benzoic acid CAS Name: cobalt; 2-(7-oxo-9-thia-6-azaspiro[4.4]nonan-6-yl)benzoic acid IUPAC Name: cobalt; 2-(7-oxo-9-thia-6-azaspiro[4.4]nonan-6-yl)benzoic acid Traditional Name: cobalt; 2-(7-keto-9-thia-6-azaspiro[4.4]nonan-6-yl)benzoic acid Formula: C28H30CoN2O6S2 MolecularWeight: 613.6108

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)N(C(=O)CS2)C3=CC=CC=C3C(=O)O.C1CCC2(C1)N(C(=O)CS2)C3=CC=CC=C3C(=O)O.[Co]

Isomeric SMILES

C1CCC2(C1)N(C(=O)CS2)C3=CC=CC=C3C(=O)O.C1CCC2(C1)N(C(=O)CS2)C3=CC=CC=C3C(=O)O.[Co]

InChI

InChI=1S/2C14H15NO3S.Co/c2*16-12-9-19-14(7-3-4-8-14)15(12)11-6-2-1-5-10(11)13(17)18;/h2*1-2,5-6H,3-4,7-9H2,(H,17,18);