dilithium; 4-azanidylsulfonyl-2-[[1,3-bis(oxidanylidene)-1-phenylazanyl-butan-2-yl]diazenyl]phenolate; cobalt(2+)

Systemtic Name: dilithium; 4-azanidylsulfonyl-2-[[1,3-bis(oxidanylidene)-1-phenylazanyl-butan-2-yl]diazenyl]phenolate; cobalt(2+) Openeye Name: cobaltous dilithium 4-azanidylsulfonyl-2-[2-oxo-1-(phenylcarbamoyl)propyl]azo-phenolate CAS Name: dilithium; 2-(1-anilino-1,3-dioxobutan-2-yl)azo-4-azanidylsulfonylphenolate; cobalt(2+) IUPAC Name: dilithium; 2-[(1-anilino-1,3-dioxobutan-2-yl)diazenyl]-4-azanidylsulfonylphenolate; cobalt(2+) Traditional Name: cobaltous dilithium 4-amidylsulfonyl-2-[2-keto-1-(phenylcarbamoyl)propyl]azo-phenolate Formula: C32H28CoLi2N8O10S2 MolecularWeight: 821.55752

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].[Li+].CC(=O)C(C(=O)NC1=CC=CC=C1)N=NC2=C(C=CC(=C2)S(=O)(=O)[NH-])[O-].CC(=O)C(C(=O)NC1=CC=CC=C1)N=NC2=C(C=CC(=C2)S(=O)(=O)[NH-])[O-].[Co+2]

Isomeric SMILES

[Li+].[Li+].CC(=O)C(C(=O)NC1=CC=CC=C1)N=NC2=C(C=CC(=C2)S(=O)(=O)[NH-])[O-].CC(=O)C(C(=O)NC1=CC=CC=C1)N=NC2=C(C=CC(=C2)S(=O)(=O)[NH-])[O-].[Co+2]

InChI

InChI=1S/2C16H16N4O5S.Co.2Li/c2*1-10(21)15(16(23)18-11-5-3-2-4-6-11)20-19-13-9-12(26(17,24)25)7-8-14(13)22;;;/h2*2-9,15H,1H3,(H4,17,18,20,22,23,24,25);;;/q;;+2;2*+1/p-4