2-[4-[(Z)-2-(4-hydroxyphenyl)-1-phenyl-but-1-enyl]phenoxy]ethyl-methyl-azanium

Systemtic Name: 2-[4-[(Z)-2-(4-hydroxyphenyl)-1-phenyl-but-1-enyl]phenoxy]ethyl-methyl-azanium Openeye Name: 2-[4-[(Z)-2-(4-hydroxyphenyl)-1-phenyl-but-1-enyl]phenoxy]ethyl-methyl-ammonium CAS Name: 2-[4-[(Z)-2-(4-hydroxyphenyl)-1-phenylbut-1-enyl]phenoxy]ethyl-methylammonium IUPAC Name: 2-[4-[(Z)-2-(4-hydroxyphenyl)-1-phenylbut-1-enyl]phenoxy]ethyl-methylazanium Traditional Name: 2-[4-[(Z)-2-(4-hydroxyphenyl)-1-phenyl-but-1-enyl]phenoxy]ethyl-methyl-ammonium Formula: C25H28NO2+ MolecularWeight: 374.49532

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1=CC=CC=C1)C2=CC=C(C=C2)OCC[NH2+]C)C3=CC=C(C=C3)O

Isomeric SMILES

CC/C(=C(\C1=CC=CC=C1)/C2=CC=C(C=C2)OCC[NH2+]C)/C3=CC=C(C=C3)O

InChI

InChI=1S/C25H27NO2/c1-3-24(19-9-13-22(27)14-10-19)25(20-7-5-4-6-8-20)21-11-15-23(16-12-21)28-18-17-26-2/h4-16,26-27H,3,17-18H2,1-2H3/p+1/b25-24-