N2,N6-bis(1,2-dimethylquinolin-1-ium-6-yl)pyridine-2,6-dicarboxamide diiodide

Systemtic Name: N2,N6-bis(1,2-dimethylquinolin-1-ium-6-yl)pyridine-2,6-dicarboxamide diiodide Openeye Name: N2,N6-bis(1,2-dimethylquinolin-1-ium-6-yl)pyridine-2,6-dicarboxamide diiodide CAS Name: N2,N6-bis(1,2-dimethyl-6-quinolin-1-iumyl)pyridine-2,6-dicarboxamide diiodide IUPAC Name: 2-N,6-N-bis(1,2-dimethylquinolin-1-ium-6-yl)pyridine-2,6-dicarboxamide diiodide Traditional Name: N,N'-bis(1,2-dimethylquinolin-1-ium-6-yl)dipicolinamide diiodide Formula: C29H27I2N5O2 MolecularWeight: 731.36592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(C=C1)C=C(C=C2)NC(=O)C3=NC(=CC=C3)C(=O)NC4=CC5=C(C=C4)[N+](=C(C=C5)C)C)C.[I-].[I-]

Isomeric SMILES

CC1=[N+](C2=C(C=C1)C=C(C=C2)NC(=O)C3=NC(=CC=C3)C(=O)NC4=CC5=C(C=C4)[N+](=C(C=C5)C)C)C.[I-].[I-]

InChI

InChI=1S/C29H25N5O2.2HI/c1-18-8-10-20-16-22(12-14-26(20)33(18)3)30-28(35)24-6-5-7-25(32-24)29(36)31-23-13-15-27-21(17-23)11-9-19(2)34(27)4;;/h5-17H,1-4H3;2*1H