2-[(E)-2-(2,5-dimethoxyphenyl)ethenyl]-1-ethyl-quinolin-1-ium iodide

Systemtic Name: 2-[(E)-2-(2,5-dimethoxyphenyl)ethenyl]-1-ethyl-quinolin-1-ium iodide Openeye Name: 2-[(E)-2-(2,5-dimethoxyphenyl)vinyl]-1-ethyl-quinolin-1-ium iodide CAS Name: 2-[(E)-2-(2,5-dimethoxyphenyl)ethenyl]-1-ethylquinolin-1-ium iodide IUPAC Name: 2-[(E)-2-(2,5-dimethoxyphenyl)ethenyl]-1-ethylquinolin-1-ium iodide Traditional Name: 2-[(E)-2-(2,5-dimethoxyphenyl)vinyl]-1-ethyl-quinolin-1-ium iodide Formula: C21H22INO2 MolecularWeight: 447.30935

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22NO2.HI/c1-4-22-18(11-9-16-7-5-6-8-20(16)22)12-10-17-15-19(23-2)13-14-21(17)24-3;/h5-15H,4H2,1-3H3;1H/q+1;/p-1/b12-10+;