5-[2-(2-methylisoquinolin-1-ylidene)ethylidene]quinolin-1-ium-8-one iodide

Systemtic Name: 5-[2-(2-methylisoquinolin-1-ylidene)ethylidene]quinolin-1-ium-8-one iodide Openeye Name: 5-[2-(2-methyl-1-isoquinolylidene)ethylidene]quinolin-1-ium-8-one iodide CAS Name: 5-[2-(2-methyl-1-isoquinolinylidene)ethylidene]-8-quinolin-1-iumone iodide IUPAC Name: 5-[2-(2-methylisoquinolin-1-ylidene)ethylidene]quinolin-1-ium-8-one iodide Traditional Name: 5-[2-(2-methyl-1-isoquinolylidene)ethylidene]quinolin-1-ium-8-one iodide Formula: C21H17IN2O MolecularWeight: 440.27695

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=CC=CC=C2C1=CC=C3C=CC(=O)C4=C3C=CC=[NH+]4.[I-]

Isomeric SMILES

CN1C=CC2=CC=CC=C2C1=CC=C3C=CC(=O)C4=C3C=CC=[NH+]4.[I-]

InChI

InChI=1S/C21H16N2O.HI/c1-23-14-12-15-5-2-3-6-17(15)19(23)10-8-16-9-11-20(24)21-18(16)7-4-13-22-21;/h2-14H,1H3;1H