1-ethyl-2-[(E)-2-(4-phenylmethoxyphenyl)ethenyl]quinolin-1-ium iodide

Systemtic Name: 1-ethyl-2-[(E)-2-(4-phenylmethoxyphenyl)ethenyl]quinolin-1-ium iodide Openeye Name: 2-[(E)-2-(4-benzyloxyphenyl)vinyl]-1-ethyl-quinolin-1-ium iodide CAS Name: 1-ethyl-2-[(E)-2-(4-phenylmethoxyphenyl)ethenyl]quinolin-1-ium iodide IUPAC Name: 1-ethyl-2-[(E)-2-(4-phenylmethoxyphenyl)ethenyl]quinolin-1-ium iodide Traditional Name: 2-[(E)-2-(4-benzoxyphenyl)vinyl]-1-ethyl-quinolin-1-ium iodide Formula: C26H24INO MolecularWeight: 493.37933

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C=CC2=CC=CC=C21)C=CC3=CC=C(C=C3)OCC4=CC=CC=C4.[I-]

Isomeric SMILES

CC[N+]1=C(C=CC2=CC=CC=C21)/C=C/C3=CC=C(C=C3)OCC4=CC=CC=C4.[I-]

InChI

InChI=1S/C26H24NO.HI/c1-2-27-24(17-15-23-10-6-7-11-26(23)27)16-12-21-13-18-25(19-14-21)28-20-22-8-4-3-5-9-22;/h3-19H,2,20H2,1H3;1H/q+1;/p-1/b16-12+;