N,N'-bis(1,2-dimethylquinolin-1-ium-4-yl)hexane-1,6-diamine iodide

Systemtic Name: N,N'-bis(1,2-dimethylquinolin-1-ium-4-yl)hexane-1,6-diamine iodide Openeye Name: N,N'-bis(1,2-dimethylquinolin-1-ium-4-yl)hexane-1,6-diamine iodide CAS Name: N,N'-bis(1,2-dimethyl-4-quinolin-1-iumyl)hexane-1,6-diamine iodide IUPAC Name: N,N'-bis(1,2-dimethylquinolin-1-ium-4-yl)hexane-1,6-diamine iodide Traditional Name: (1,2-dimethylquinolin-1-ium-4-yl)-[6-[(1,2-dimethylquinolin-1-ium-4-yl)amino]hexyl]amine iodide Formula: C28H36IN4+ MolecularWeight: 555.51671

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2C(=C1)NCCCCCCNC3=CC(=[N+](C4=CC=CC=C43)C)C)C.[I-]

Isomeric SMILES

CC1=[N+](C2=CC=CC=C2C(=C1)NCCCCCCNC3=CC(=[N+](C4=CC=CC=C43)C)C)C.[I-]

InChI

InChI=1S/C28H34N4.HI/c1-21-19-25(23-13-7-9-15-27(23)31(21)3)29-17-11-5-6-12-18-30-26-20-22(2)32(4)28-16-10-8-14-24(26)28;/h7-10,13-16,19-20H,5-6,11-12,17-18H2,1-4H3;1H/p+1