2-(17-isoquinolin-2-ium-2-ylheptadecyl)isoquinolin-2-ium diiodide

Systemtic Name: 2-(17-isoquinolin-2-ium-2-ylheptadecyl)isoquinolin-2-ium diiodide Openeye Name: 2-(17-isoquinolin-2-ium-2-ylheptadecyl)isoquinolin-2-ium diiodide CAS Name: 2-[17-(2-isoquinolin-2-iumyl)heptadecyl]isoquinolin-2-ium diiodide IUPAC Name: 2-(17-isoquinolin-2-ium-2-ylheptadecyl)isoquinolin-2-ium diiodide Traditional Name: 2-(17-isoquinolin-2-ium-2-ylheptadecyl)isoquinolin-2-ium diiodide Formula: C35H48I2N2 MolecularWeight: 750.57796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CCCCCCCCCCCCCCCCC[N+]3=CC4=CC=CC=C4C=C3.[I-].[I-]

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CCCCCCCCCCCCCCCCC[N+]3=CC4=CC=CC=C4C=C3.[I-].[I-]

InChI

InChI=1S/C35H48N2.2HI/c1(2-4-6-8-10-12-18-26-36-28-24-32-20-14-16-22-34(32)30-36)3-5-7-9-11-13-19-27-37-29-25-33-21-15-17-23-35(33)31-37;;/h14-17,20-25,28-31H,1-13,18-19,26-27H2;2*1H/q+2;;/p-2