4-[(E)-2-[4-[(E)-2-(4-dec-9-enoxyphenyl)ethenyl]phenyl]ethenyl]-1-ethyl-pyridin-1-ium bromide

Systemtic Name: 4-[(E)-2-[4-[(E)-2-(4-dec-9-enoxyphenyl)ethenyl]phenyl]ethenyl]-1-ethyl-pyridin-1-ium bromide Openeye Name: 4-[(E)-2-[4-[(E)-2-(4-dec-9-enoxyphenyl)vinyl]phenyl]vinyl]-1-ethyl-pyridin-1-ium bromide CAS Name: 4-[(E)-2-[4-[(E)-2-(4-dec-9-enoxyphenyl)ethenyl]phenyl]ethenyl]-1-ethylpyridin-1-ium bromide IUPAC Name: 4-[(E)-2-[4-[(E)-2-(4-dec-9-enoxyphenyl)ethenyl]phenyl]ethenyl]-1-ethylpyridin-1-ium bromide Traditional Name: 4-[(E)-2-[4-[(E)-2-(4-dec-9-enoxyphenyl)vinyl]phenyl]vinyl]-1-ethyl-pyridin-1-ium bromide Formula: C33H40BrNO MolecularWeight: 546.5808

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=C(C=C1)C=CC2=CC=C(C=C2)C=CC3=CC=C(C=C3)OCCCCCCCCC=C.[Br-]

Isomeric SMILES

CC[N+]1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)/C=C/C3=CC=C(C=C3)OCCCCCCCCC=C.[Br-]

InChI

InChI=1S/C33H40NO.BrH/c1-3-5-6-7-8-9-10-11-28-35-33-22-20-31(21-23-33)17-16-29-12-14-30(15-13-29)18-19-32-24-26-34(4-2)27-25-32;/h3,12-27H,1,4-11,28H2,2H3;1H/q+1;/p-1/b17-16+,19-18+;