2-methyl-4-pyridin-3-yl-isoquinolin-2-ium iodide

Systemtic Name: 2-methyl-4-pyridin-3-yl-isoquinolin-2-ium iodide Openeye Name: 2-methyl-4-(3-pyridyl)isoquinolin-2-ium iodide CAS Name: 2-methyl-4-(3-pyridinyl)isoquinolin-2-ium iodide IUPAC Name: 2-methyl-4-pyridin-3-ylisoquinolin-2-ium iodide Traditional Name: 2-methyl-4-(3-pyridyl)isoquinolin-2-ium iodide Formula: C15H13IN2 MolecularWeight: 348.18159

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC2=CC=CC=C2C(=C1)C3=CN=CC=C3.[I-]

Isomeric SMILES

C[N+]1=CC2=CC=CC=C2C(=C1)C3=CN=CC=C3.[I-]

InChI

InChI=1S/C15H13N2.HI/c1-17-10-13-5-2-3-7-14(13)15(11-17)12-6-4-8-16-9-12;/h2-11H,1H3;1H/q+1;/p-1