2-[2-(isoquinolin-2-ium-2-ylmethoxy)ethoxymethyl]isoquinolin-2-ium

Systemtic Name: 2-[2-(isoquinolin-2-ium-2-ylmethoxy)ethoxymethyl]isoquinolin-2-ium Openeye Name: 2-[2-(isoquinolin-2-ium-2-ylmethoxy)ethoxymethyl]isoquinolin-2-ium CAS Name: 2-[2-(2-isoquinolin-2-iumylmethoxy)ethoxymethyl]isoquinolin-2-ium IUPAC Name: 2-[2-(isoquinolin-2-ium-2-ylmethoxy)ethoxymethyl]isoquinolin-2-ium Traditional Name: 2-[2-(isoquinolin-2-ium-2-ylmethoxy)ethoxymethyl]isoquinolin-2-ium Formula: C22H22N2O2+2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)COCCOC[N+]3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)COCCOC[N+]3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H22N2O2/c1-3-7-21-15-23(11-9-19(21)5-1)17-25-13-14-26-18-24-12-10-20-6-2-4-8-22(20)16-24/h1-12,15-16H,13-14,17-18H2/q+2