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

Systemtic Name: N2,N6-bis(1-methylquinolin-1-ium-6-yl)pyridine-2,6-dicarboxamide diiodide Openeye Name: N2,N6-bis(1-methylquinolin-1-ium-6-yl)pyridine-2,6-dicarboxamide diiodide CAS Name: N2,N6-bis(1-methyl-6-quinolin-1-iumyl)pyridine-2,6-dicarboxamide diiodide IUPAC Name: 2-N,6-N-bis(1-methylquinolin-1-ium-6-yl)pyridine-2,6-dicarboxamide diiodide Traditional Name: N,N'-bis(1-methylquinolin-1-ium-6-yl)dipicolinamide diiodide Formula: C27H23I2N5O2 MolecularWeight: 703.31276

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)C3=NC(=CC=C3)C(=O)NC4=CC5=C(C=C4)[N+](=CC=C5)C.[I-].[I-]

Isomeric SMILES

C[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)C3=NC(=CC=C3)C(=O)NC4=CC5=C(C=C4)[N+](=CC=C5)C.[I-].[I-]

InChI

InChI=1S/C27H21N5O2.2HI/c1-31-14-4-6-18-16-20(10-12-24(18)31)28-26(33)22-8-3-9-23(30-22)27(34)29-21-11-13-25-19(17-21)7-5-15-32(25)2;;/h3-17H,1-2H3;2*1H