4-[2-(4-hexoxy-3-methoxy-phenyl)ethenyl]-1-methyl-pyridin-1-ium

Systemtic Name: 4-[2-(4-hexoxy-3-methoxy-phenyl)ethenyl]-1-methyl-pyridin-1-ium Openeye Name: 4-[2-(4-hexoxy-3-methoxy-phenyl)vinyl]-1-methyl-pyridin-1-ium CAS Name: 4-[2-(4-hexoxy-3-methoxyphenyl)ethenyl]-1-methylpyridin-1-ium IUPAC Name: 4-[2-(4-hexoxy-3-methoxyphenyl)ethenyl]-1-methylpyridin-1-ium Traditional Name: 4-[2-(4-hexoxy-3-methoxy-phenyl)vinyl]-1-methyl-pyridin-1-ium Formula: C21H28NO2+ MolecularWeight: 326.45252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=CC2=CC=[N+](C=C2)C)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C=CC2=CC=[N+](C=C2)C)OC

InChI

InChI=1S/C21H28NO2/c1-4-5-6-7-16-24-20-11-10-19(17-21(20)23-3)9-8-18-12-14-22(2)15-13-18/h8-15,17H,4-7,16H2,1-3H3/q+1