2-(2-pyridin-2-ylethyl)isoquinolin-2-ium chloride hydrochloride

Systemtic Name: 2-(2-pyridin-2-ylethyl)isoquinolin-2-ium chloride hydrochloride Openeye Name: 2-[2-(2-pyridyl)ethyl]isoquinolin-2-ium chloride hydrochloride CAS Name: 2-[2-(2-pyridinyl)ethyl]isoquinolin-2-ium chloride hydrochloride IUPAC Name: 2-(2-pyridin-2-ylethyl)isoquinolin-2-ium chloride hydrochloride Traditional Name: 2-[2-(2-pyridyl)ethyl]isoquinolin-2-ium chloride hydrochloride Formula: C16H16Cl2N2 MolecularWeight: 307.21764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CCC3=CC=CC=N3.Cl.[Cl-]

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CCC3=CC=CC=N3.Cl.[Cl-]

InChI

InChI=1S/C16H15N2.2ClH/c1-2-6-15-13-18(11-8-14(15)5-1)12-9-16-7-3-4-10-17-16;;/h1-8,10-11,13H,9,12H2;2*1H/q+1;;/p-1