2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]ethyl-(2-iodanylethyl)-dimethyl-azanium

Systemtic Name: 2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]ethyl-(2-iodanylethyl)-dimethyl-azanium Openeye Name: 2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]ethyl-(2-iodoethyl)-dimethyl-ammonium CAS Name: 2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]ethyl-(2-iodoethyl)-dimethylammonium IUPAC Name: 2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]ethyl-(2-iodoethyl)-dimethylazanium Traditional Name: 2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]ethyl-(2-iodoethyl)-dimethyl-ammonium Formula: C28H33INO+ MolecularWeight: 526.47219

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1=CC=CC=C1)C2=CC=C(C=C2)OCC[N+](C)(C)CCI)C3=CC=CC=C3

Isomeric SMILES

CC/C(=C(\C1=CC=CC=C1)/C2=CC=C(C=C2)OCC[N+](C)(C)CCI)/C3=CC=CC=C3

InChI

InChI=1S/C28H33INO/c1-4-27(23-11-7-5-8-12-23)28(24-13-9-6-10-14-24)25-15-17-26(18-16-25)31-22-21-30(2,3)20-19-29/h5-18H,4,19-22H2,1-3H3/q+1/b28-27-