2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-methyl-quinolin-1-ium iodide

Systemtic Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-methyl-quinolin-1-ium iodide Openeye Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-1-methyl-quinolin-1-ium iodide CAS Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-methylquinolin-1-ium iodide IUPAC Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-methylquinolin-1-ium iodide Traditional Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-1-methyl-quinolin-1-ium iodide Formula: C19H16INO2 MolecularWeight: 417.24031

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=CC2=CC=CC=C21)C=CC3=CC4=C(C=C3)OCO4.[I-]

Isomeric SMILES

C[N+]1=C(C=CC2=CC=CC=C21)/C=C/C3=CC4=C(C=C3)OCO4.[I-]

InChI

InChI=1S/C19H16NO2.HI/c1-20-16(10-8-15-4-2-3-5-17(15)20)9-6-14-7-11-18-19(12-14)22-13-21-18;/h2-12H,13H2,1H3;1H/q+1;/p-1/b9-6+;