1,10-bis(1-tetradecylpyridin-1-ium-4-yl)decane-2,3,8,9-tetrone diiodide

Systemtic Name: 1,10-bis(1-tetradecylpyridin-1-ium-4-yl)decane-2,3,8,9-tetrone diiodide Openeye Name: 1,10-bis(1-tetradecylpyridin-1-ium-4-yl)decane-2,3,8,9-tetrone diiodide CAS Name: 1,10-bis(1-tetradecyl-4-pyridin-1-iumyl)decane-2,3,8,9-tetrone diiodide IUPAC Name: 1,10-bis(1-tetradecylpyridin-1-ium-4-yl)decane-2,3,8,9-tetrone diiodide Traditional Name: 1,10-bis(1-myristylpyridin-1-ium-4-yl)decane-2,3,8,9-tetrone diiodide Formula: C48H78I2N2O4 MolecularWeight: 1000.95286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC[N+]1=CC=C(C=C1)CC(=O)C(=O)CCCCC(=O)C(=O)CC2=CC=[N+](C=C2)CCCCCCCCCCCCCC.[I-].[I-]

Isomeric SMILES

CCCCCCCCCCCCCC[N+]1=CC=C(C=C1)CC(=O)C(=O)CCCCC(=O)C(=O)CC2=CC=[N+](C=C2)CCCCCCCCCCCCCC.[I-].[I-]

InChI

InChI=1S/C48H78N2O4.2HI/c1-3-5-7-9-11-13-15-17-19-21-23-27-35-49-37-31-43(32-38-49)41-47(53)45(51)29-25-26-30-46(52)48(54)42-44-33-39-50(40-34-44)36-28-24-22-20-18-16-14-12-10-8-6-4-2;;/h31-34,37-40H,3-30,35-36,41-42H2,1-2H3;2*1H/q+2;;/p-2