2-[4-[(E)-1,2-diphenylbut-1-enyl]phenoxy]ethyl-trimethyl-azanium

Systemtic Name: 2-[4-[(E)-1,2-diphenylbut-1-enyl]phenoxy]ethyl-trimethyl-azanium Openeye Name: 2-[4-[(E)-1,2-diphenylbut-1-enyl]phenoxy]ethyl-trimethyl-ammonium CAS Name: 2-[4-[(E)-1,2-diphenylbut-1-enyl]phenoxy]ethyl-trimethylammonium IUPAC Name: 2-[4-[(E)-1,2-diphenylbut-1-enyl]phenoxy]ethyl-trimethylazanium Traditional Name: 2-[4-[(E)-1,2-diphenylbut-1-enyl]phenoxy]ethyl-trimethyl-ammonium Formula: C27H32NO+ MolecularWeight: 386.54908

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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)C)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C27H32NO/c1-5-26(22-12-8-6-9-13-22)27(23-14-10-7-11-15-23)24-16-18-25(19-17-24)29-21-20-28(2,3)4/h6-19H,5,20-21H2,1-4H3/q+1/b27-26+