4-[2-(6-ethoxy-1-methyl-quinolin-2-ylidene)ethylidene]quinolin-1-ium-8-one iodide

Systemtic Name: 4-[2-(6-ethoxy-1-methyl-quinolin-2-ylidene)ethylidene]quinolin-1-ium-8-one iodide Openeye Name: 4-[2-(6-ethoxy-1-methyl-2-quinolylidene)ethylidene]quinolin-1-ium-8-one iodide CAS Name: 4-[2-(6-ethoxy-1-methyl-2-quinolinylidene)ethylidene]-8-quinolin-1-iumone iodide IUPAC Name: 4-[2-(6-ethoxy-1-methylquinolin-2-ylidene)ethylidene]quinolin-1-ium-8-one iodide Traditional Name: 4-[2-(6-ethoxy-1-methyl-2-quinolylidene)ethylidene]quinolin-1-ium-8-one iodide Formula: C23H21IN2O2 MolecularWeight: 484.32951

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=CC=C3C=C[NH+]=C4C3=CC=CC4=O)C=C2)C.[I-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=CC=C3C=C[NH+]=C4C3=CC=CC4=O)C=C2)C.[I-]

InChI

InChI=1S/C23H20N2O2.HI/c1-3-27-19-11-12-21-17(15-19)8-10-18(25(21)2)9-7-16-13-14-24-23-20(16)5-4-6-22(23)26;/h4-15H,3H2,1-2H3;1H